 vasp.5.4.1 24Jun15 (build Jul 10 2015 19:11:35) complex                        
  
 executed on           IFC91_ompi date 2016.11.10  01:17:24
 running on   40 total cores
 distrk:  each k-point on   20 cores,    2 groups
 distr:  one band on NCORES_PER_BAND=   1 cores,   20 groups


--------------------------------------------------------------------------------------------------------


 INCAR:
 POTCAR:    PAW C 22Mar2012                       

 ----------------------------------------------------------------------------- 
|                                                                             |
|           W    W    AA    RRRRR   N    N  II  N    N   GGGG   !!!           |
|           W    W   A  A   R    R  NN   N  II  NN   N  G    G  !!!           |
|           W    W  A    A  R    R  N N  N  II  N N  N  G       !!!           |
|           W WW W  AAAAAA  RRRRR   N  N N  II  N  N N  G  GGG   !            |
|           WW  WW  A    A  R   R   N   NN  II  N   NN  G    G                |
|           W    W  A    A  R    R  N    N  II  N    N   GGGG   !!!           |
|                                                                             |
|      For optimal performance we recommend to set                            |
|        NCORE= 4 - approx SQRT( number of cores)                             |
|      NCORE specifies how many cores store one orbital (NPAR=cpu/NCORE).     |
|      This setting can  greatly improve the performance of VASP for DFT.     |
|      The default, NPAR=number of cores might be grossly inefficient         |
|      on modern multi-core architectures or massively parallel machines.     |
|      Do your own testing !!!!                                               |
|      Unfortunately you need to use the default for GW and RPA calculations. |
|      (for HF NCORE is supported but not extensively tested yet)             |
|                                                                             |
 ----------------------------------------------------------------------------- 


 ----------------------------------------------------------------------------- 
|                                                                             |
|           W    W    AA    RRRRR   N    N  II  N    N   GGGG   !!!           |
|           W    W   A  A   R    R  NN   N  II  NN   N  G    G  !!!           |
|           W    W  A    A  R    R  N N  N  II  N N  N  G       !!!           |
|           W WW W  AAAAAA  RRRRR   N  N N  II  N  N N  G  GGG   !            |
|           WW  WW  A    A  R   R   N   NN  II  N   NN  G    G                |
|           W    W  A    A  R    R  N    N  II  N    N   GGGG   !!!           |
|                                                                             |
|      You have enabled k-point parallelism (KPAR>1).                         |
|      This developmental code was originally  written by Paul Kent at ORNL,  |
|      and carefully double checked in Vienna.                                |
|      GW as well as linear response parallelism added by Martijn Marsman     |
|      and Georg Kresse.                                                      |
|      Carefully verify results versus KPAR=1.                                |
|      Report problems to Paul Kent and Vienna.                               |
|                                                                             |
 ----------------------------------------------------------------------------- 

 POTCAR:    PAW C 22Mar2012                       
   VRHFIN =C: s2p2                                                              
   LEXCH  = CA                                                                  
   EATOM  =   146.6860 eV,   10.7811 Ry                                         
                                                                                
   TITEL  = PAW C 22Mar2012                                                     
   LULTRA =        F    use ultrasoft PP ?                                      
   IUNSCR =        1    unscreen: 0-lin 1-nonlin 2-no                           
   RPACOR =    1.200    partial core radius                                     
   POMASS =   12.011; ZVAL   =    4.000    mass and valenz                      
   RCORE  =    1.500    outmost cutoff radius                                   
   RWIGS  =    1.630; RWIGS  =    0.863    wigner-seitz radius (au A)           
   ENMAX  =  400.000; ENMIN  =  300.000 eV                                      
   ICORE  =        2    local potential                                         
   LCOR   =        T    correct aug charges                                     
   LPAW   =        T    paw PP                                                  
   EAUG   =  644.873                                                            
   DEXC   =    0.000                                                            
   RMAX   =    1.529    core radius for proj-oper                               
   RAUG   =    1.300    factor for augmentation sphere                          
   RDEP   =    1.501    radius for radial grids                                 
   RDEPT  =    1.300    core radius for aug-charge                              
                                                                                
   Atomic configuration                                                         
    4 entries                                                                   
     n  l   j            E        occ.                                          
     1  0  0.50      -270.6511   2.0000                                         
     2  0  0.50       -13.6383   2.0000                                         
     2  1  0.50        -5.4212   2.0000                                         
     3  2  1.50        -5.4423   0.0000                                         
   Description                                                                  
     l       E           TYP  RCUT    TYP  RCUT                                 
     0    -13.6382841     23  1.200                                             
     0     -7.9195854     23  1.200                                             
     1     -5.4211532     23  1.500                                             
     1     34.0145650     23  1.500                                             
     2     -5.4423304      7  1.500                                             
  local pseudopotential read in
  partial core-charges read in
  partial kinetic energy density read in
  kinetic energy density of atom read in
  atomic valenz-charges read in
  non local Contribution for L=           0  read in
    real space projection operators read in
  non local Contribution for L=           0  read in
    real space projection operators read in
  non local Contribution for L=           1  read in
    real space projection operators read in
  non local Contribution for L=           1  read in
    real space projection operators read in
    PAW grid and wavefunctions read in
 
   number of l-projection  operators is LMAX  =           4
   number of lm-projection operators is LMMAX =           8
 
  PAW C 22Mar2012                       :
 energy of atom  1       EATOM= -146.6860
 kinetic energy error for atom=    0.0289 (will be added to EATOM!!)
 
 
 POSCAR: cif to poscar ['C']                     
  positions in direct lattice
  velocities in cartesian coordinates
 exchange correlation table for  LEXCH =        2
   RHO(1)=    0.500       N(1)  =     2000
   RHO(2)=  100.500       N(2)  =     4000
 


--------------------------------------------------------------------------------------------------------


 ion  position               nearest neighbor table
   1  0.000  0.000  0.000-   2 1.53   2 1.53   2 1.53   2 1.53
   2  0.250  0.250  0.250-   1 1.53   1 1.53   1 1.53   1 1.53
 
  LATTYP: Found a face centered cubic cell.
 ALAT       =     3.5263137898
  
  Lattice vectors:
  
 A1 = (   0.0000000000,   1.7631568949,   1.7631568949)
 A2 = (   1.7631568949,   0.0000000000,   1.7631568949)
 A3 = (   1.7631568949,   1.7631568949,   0.0000000000)


Analysis of symmetry for initial positions (statically):
=====================================================================
 Subroutine PRICEL returns:
 Original cell was already a primitive cell.
 

 Routine SETGRP: Setting up the symmetry group for a 
 face centered cubic supercell.


 Subroutine GETGRP returns: Found 48 space group operations
 (whereof 24 operations were pure point group operations)
 out of a pool of 48 trial point group operations.


The static configuration has the point symmetry T_d .
 The point group associated with its full space group is O_h .


Analysis of symmetry for dynamics (positions and initial velocities):
=====================================================================
 Subroutine PRICEL returns:
 Original cell was already a primitive cell.
 

 Routine SETGRP: Setting up the symmetry group for a 
 face centered cubic supercell.


 Subroutine GETGRP returns: Found 48 space group operations
 (whereof 24 operations were pure point group operations)
 out of a pool of 48 trial point group operations.


The dynamic configuration has the point symmetry T_d .
 The point group associated with its full space group is O_h .


Analysis of constrained symmetry for selective dynamics:
=====================================================================
 Subroutine PRICEL returns:
 Original cell was already a primitive cell.
 

 Routine SETGRP: Setting up the symmetry group for a 
 face centered cubic supercell.


 Subroutine GETGRP returns: Found 48 space group operations
 (whereof 24 operations were pure point group operations)
 out of a pool of 48 trial point group operations.


The constrained configuration has the point symmetry T_d .
 The point group associated with its full space group is O_h .
 
 
 KPOINTS: Auto k-point                            

Automatic generation of k-mesh.
Space group operators:
 irot       det(A)        alpha          n_x          n_y          n_z        tau_x        tau_y        tau_z
    1     1.000000     0.000000     1.000000     0.000000     0.000000     0.000000     0.000000     0.000000
    2     1.000000   120.000000    -0.577350    -0.577350    -0.577350     0.000000     0.000000     0.000000
    3     1.000000   120.000000     0.577350     0.577350     0.577350     0.000000     0.000000     0.000000
    4    -1.000000    90.000000     0.000000     0.000000    -1.000000     0.000000     0.000000     0.000000
    5    -1.000000   180.000000     0.000000     0.707107     0.707107     0.000000     0.000000     0.000000
    6    -1.000000    90.000000     0.000000     1.000000     0.000000     0.000000     0.000000     0.000000
    7     1.000000   179.999999     0.000000     0.000000     1.000000     0.000000     0.000000     0.000000
    8     1.000000   120.000000    -0.577350     0.577350     0.577350     0.000000     0.000000     0.000000
    9     1.000000   120.000000    -0.577350     0.577350    -0.577350     0.000000     0.000000     0.000000
   10    -1.000000    90.000000     0.000000     0.000000     1.000000     0.000000     0.000000     0.000000
   11    -1.000000    90.000000    -1.000000     0.000000     0.000000     0.000000     0.000000     0.000000
   12    -1.000000   180.000000     0.707107     0.000000     0.707107     0.000000     0.000000     0.000000
   13     1.000000   120.000000     0.577350    -0.577350     0.577350     0.000000     0.000000     0.000000
   14     1.000000   120.000000    -0.577350    -0.577350     0.577350     0.000000     0.000000     0.000000
   15     1.000000   180.000000     1.000000     0.000000     0.000000     0.000000     0.000000     0.000000
   16    -1.000000    90.000000     0.000000    -1.000000     0.000000     0.000000     0.000000     0.000000
   17    -1.000000   180.000000     0.707107     0.707107     0.000000     0.000000     0.000000     0.000000
   18    -1.000000    90.000000     1.000000     0.000000     0.000000     0.000000     0.000000     0.000000
   19     1.000000   120.000000     0.577350    -0.577350    -0.577350     0.000000     0.000000     0.000000
   20     1.000000   180.000000     0.000000     1.000000     0.000000     0.000000     0.000000     0.000000
   21     1.000000   120.000000     0.577350     0.577350    -0.577350     0.000000     0.000000     0.000000
   22    -1.000000   180.000000     0.000000    -0.707107     0.707107     0.000000     0.000000     0.000000
   23    -1.000000   180.000000     0.707107    -0.707107     0.000000     0.000000     0.000000     0.000000
   24    -1.000000   180.000000     0.707107     0.000000    -0.707107     0.000000     0.000000     0.000000
   25    -1.000000     0.000000     1.000000     0.000000     0.000000     0.250000     0.250000     0.250000
   26    -1.000000   120.000000    -0.577350    -0.577350    -0.577350     0.250000     0.250000     0.250000
   27    -1.000000   120.000000     0.577350     0.577350     0.577350     0.250000     0.250000     0.250000
   28     1.000000    90.000000     0.000000     0.000000    -1.000000     0.250000     0.250000     0.250000
   29     1.000000   180.000000     0.000000     0.707107     0.707107     0.250000     0.250000     0.250000
   30     1.000000    90.000000     0.000000     1.000000     0.000000     0.250000     0.250000     0.250000
   31    -1.000000   179.999999     0.000000     0.000000     1.000000     0.250000     0.250000     0.250000
   32    -1.000000   120.000000    -0.577350     0.577350     0.577350     0.250000     0.250000     0.250000
   33    -1.000000   120.000000    -0.577350     0.577350    -0.577350     0.250000     0.250000     0.250000
   34     1.000000    90.000000     0.000000     0.000000     1.000000     0.250000     0.250000     0.250000
   35     1.000000    90.000000    -1.000000     0.000000     0.000000     0.250000     0.250000     0.250000
   36     1.000000   180.000000     0.707107     0.000000     0.707107     0.250000     0.250000     0.250000
   37    -1.000000   120.000000     0.577350    -0.577350     0.577350     0.250000     0.250000     0.250000
   38    -1.000000   120.000000    -0.577350    -0.577350     0.577350     0.250000     0.250000     0.250000
   39    -1.000000   180.000000     1.000000     0.000000     0.000000     0.250000     0.250000     0.250000
   40     1.000000    90.000000     0.000000    -1.000000     0.000000     0.250000     0.250000     0.250000
   41     1.000000   180.000000     0.707107     0.707107     0.000000     0.250000     0.250000     0.250000
   42     1.000000    90.000000     1.000000     0.000000     0.000000     0.250000     0.250000     0.250000
   43    -1.000000   120.000000     0.577350    -0.577350    -0.577350     0.250000     0.250000     0.250000
   44    -1.000000   180.000000     0.000000     1.000000     0.000000     0.250000     0.250000     0.250000
   45    -1.000000   120.000000     0.577350     0.577350    -0.577350     0.250000     0.250000     0.250000
   46     1.000000   180.000000     0.000000    -0.707107     0.707107     0.250000     0.250000     0.250000
   47     1.000000   180.000000     0.707107    -0.707107     0.000000     0.250000     0.250000     0.250000
   48     1.000000   180.000000     0.707107     0.000000    -0.707107     0.250000     0.250000     0.250000
 
 Subroutine IBZKPT returns following result:
 ===========================================
 
 Found    182 irreducible k-points:
 
 Following reciprocal coordinates:
            Coordinates               Weight
  0.041667  0.041667  0.041667     96.000000
  0.125000  0.041667  0.041667    288.000000
  0.208333  0.041667  0.041667    288.000000
  0.291667  0.041667  0.041667    288.000000
  0.375000  0.041667  0.041667    288.000000
  0.458333  0.041667  0.041667    288.000000
 -0.458333  0.041667  0.041667    288.000000
 -0.375000  0.041667  0.041667    288.000000
 -0.291667  0.041667  0.041667    288.000000
 -0.208333  0.041667  0.041667    288.000000
 -0.125000  0.041667  0.041667    288.000000
 -0.041667  0.041667  0.041667    288.000000
  0.125000  0.125000  0.041667    288.000000
  0.208333  0.125000  0.041667    576.000000
  0.291667  0.125000  0.041667    576.000000
  0.375000  0.125000  0.041667    576.000000
  0.458333  0.125000  0.041667    576.000000
 -0.458333  0.125000  0.041667    576.000000
 -0.375000  0.125000  0.041667    576.000000
 -0.291667  0.125000  0.041667    576.000000
 -0.208333  0.125000  0.041667    576.000000
 -0.125000  0.125000  0.041667    576.000000
 -0.041667  0.125000  0.041667    576.000000
  0.208333  0.208333  0.041667    288.000000
  0.291667  0.208333  0.041667    576.000000
  0.375000  0.208333  0.041667    576.000000
  0.458333  0.208333  0.041667    576.000000
 -0.458333  0.208333  0.041667    576.000000
 -0.375000  0.208333  0.041667    576.000000
 -0.291667  0.208333  0.041667    576.000000
 -0.208333  0.208333  0.041667    576.000000
 -0.125000  0.208333  0.041667    576.000000
 -0.041667  0.208333  0.041667    576.000000
  0.291667  0.291667  0.041667    288.000000
  0.375000  0.291667  0.041667    576.000000
  0.458333  0.291667  0.041667    576.000000
 -0.458333  0.291667  0.041667    576.000000
 -0.375000  0.291667  0.041667    576.000000
 -0.291667  0.291667  0.041667    576.000000
 -0.208333  0.291667  0.041667    576.000000
 -0.125000  0.291667  0.041667    576.000000
 -0.041667  0.291667  0.041667    576.000000
  0.375000  0.375000  0.041667    288.000000
  0.458333  0.375000  0.041667    576.000000
 -0.458333  0.375000  0.041667    576.000000
 -0.375000  0.375000  0.041667    576.000000
 -0.291667  0.375000  0.041667    576.000000
 -0.208333  0.375000  0.041667    576.000000
 -0.125000  0.375000  0.041667    576.000000
 -0.041667  0.375000  0.041667    576.000000
  0.458333  0.458333  0.041667    288.000000
 -0.458333  0.458333  0.041667    576.000000
 -0.375000  0.458333  0.041667    576.000000
 -0.291667  0.458333  0.041667    576.000000
 -0.208333  0.458333  0.041667    576.000000
 -0.125000  0.458333  0.041667    576.000000
 -0.041667  0.458333  0.041667    576.000000
 -0.458333 -0.458333  0.041667    288.000000
 -0.375000 -0.458333  0.041667    576.000000
 -0.291667 -0.458333  0.041667    576.000000
 -0.208333 -0.458333  0.041667    576.000000
 -0.125000 -0.458333  0.041667    576.000000
 -0.375000 -0.375000  0.041667    288.000000
 -0.291667 -0.375000  0.041667    576.000000
 -0.208333 -0.375000  0.041667    576.000000
 -0.125000 -0.375000  0.041667    576.000000
 -0.291667 -0.291667  0.041667    288.000000
 -0.208333 -0.291667  0.041667    576.000000
 -0.125000 -0.291667  0.041667    576.000000
 -0.208333 -0.208333  0.041667    288.000000
 -0.125000 -0.208333  0.041667    576.000000
 -0.125000 -0.125000  0.041667    288.000000
  0.125000  0.125000  0.125000     96.000000
  0.208333  0.125000  0.125000    288.000000
  0.291667  0.125000  0.125000    288.000000
  0.375000  0.125000  0.125000    288.000000
  0.458333  0.125000  0.125000    288.000000
 -0.458333  0.125000  0.125000    288.000000
 -0.375000  0.125000  0.125000    288.000000
 -0.291667  0.125000  0.125000    288.000000
 -0.208333  0.125000  0.125000    288.000000
 -0.125000  0.125000  0.125000    288.000000
  0.208333  0.208333  0.125000    288.000000
  0.291667  0.208333  0.125000    576.000000
  0.375000  0.208333  0.125000    576.000000
  0.458333  0.208333  0.125000    576.000000
 -0.458333  0.208333  0.125000    576.000000
 -0.375000  0.208333  0.125000    576.000000
 -0.291667  0.208333  0.125000    576.000000
 -0.208333  0.208333  0.125000    576.000000
 -0.125000  0.208333  0.125000    576.000000
  0.291667  0.291667  0.125000    288.000000
  0.375000  0.291667  0.125000    576.000000
  0.458333  0.291667  0.125000    576.000000
 -0.458333  0.291667  0.125000    576.000000
 -0.375000  0.291667  0.125000    576.000000
 -0.291667  0.291667  0.125000    576.000000
 -0.208333  0.291667  0.125000    576.000000
 -0.125000  0.291667  0.125000    576.000000
  0.375000  0.375000  0.125000    288.000000
  0.458333  0.375000  0.125000    576.000000
 -0.458333  0.375000  0.125000    576.000000
 -0.375000  0.375000  0.125000    576.000000
 -0.291667  0.375000  0.125000    576.000000
 -0.208333  0.375000  0.125000    576.000000
 -0.125000  0.375000  0.125000    576.000000
  0.458333  0.458333  0.125000    288.000000
 -0.458333  0.458333  0.125000    576.000000
 -0.375000  0.458333  0.125000    576.000000
 -0.291667  0.458333  0.125000    576.000000
 -0.208333  0.458333  0.125000    576.000000
 -0.125000  0.458333  0.125000    576.000000
 -0.458333 -0.458333  0.125000    288.000000
 -0.375000 -0.458333  0.125000    576.000000
 -0.291667 -0.458333  0.125000    576.000000
 -0.208333 -0.458333  0.125000    576.000000
 -0.375000 -0.375000  0.125000    288.000000
 -0.291667 -0.375000  0.125000    576.000000
 -0.208333 -0.375000  0.125000    576.000000
 -0.291667 -0.291667  0.125000    288.000000
 -0.208333 -0.291667  0.125000    576.000000
 -0.208333 -0.208333  0.125000    288.000000
  0.208333  0.208333  0.208333     96.000000
  0.291667  0.208333  0.208333    288.000000
  0.375000  0.208333  0.208333    288.000000
  0.458333  0.208333  0.208333    288.000000
 -0.458333  0.208333  0.208333    288.000000
 -0.375000  0.208333  0.208333    288.000000
 -0.291667  0.208333  0.208333    288.000000
 -0.208333  0.208333  0.208333    288.000000
  0.291667  0.291667  0.208333    288.000000
  0.375000  0.291667  0.208333    576.000000
  0.458333  0.291667  0.208333    576.000000
 -0.458333  0.291667  0.208333    576.000000
 -0.375000  0.291667  0.208333    576.000000
 -0.291667  0.291667  0.208333    576.000000
 -0.208333  0.291667  0.208333    576.000000
  0.375000  0.375000  0.208333    288.000000
  0.458333  0.375000  0.208333    576.000000
 -0.458333  0.375000  0.208333    576.000000
 -0.375000  0.375000  0.208333    576.000000
 -0.291667  0.375000  0.208333    576.000000
 -0.208333  0.375000  0.208333    576.000000
  0.458333  0.458333  0.208333    288.000000
 -0.458333  0.458333  0.208333    576.000000
 -0.375000  0.458333  0.208333    576.000000
 -0.291667  0.458333  0.208333    576.000000
 -0.208333  0.458333  0.208333    576.000000
 -0.458333 -0.458333  0.208333    288.000000
 -0.375000 -0.458333  0.208333    576.000000
 -0.291667 -0.458333  0.208333    576.000000
 -0.375000 -0.375000  0.208333    288.000000
 -0.291667 -0.375000  0.208333    576.000000
 -0.291667 -0.291667  0.208333    288.000000
  0.291667  0.291667  0.291667     96.000000
  0.375000  0.291667  0.291667    288.000000
  0.458333  0.291667  0.291667    288.000000
 -0.458333  0.291667  0.291667    288.000000
 -0.375000  0.291667  0.291667    288.000000
 -0.291667  0.291667  0.291667    288.000000
  0.375000  0.375000  0.291667    288.000000
  0.458333  0.375000  0.291667    576.000000
 -0.458333  0.375000  0.291667    576.000000
 -0.375000  0.375000  0.291667    576.000000
 -0.291667  0.375000  0.291667    576.000000
  0.458333  0.458333  0.291667    288.000000
 -0.458333  0.458333  0.291667    576.000000
 -0.375000  0.458333  0.291667    576.000000
 -0.291667  0.458333  0.291667    576.000000
 -0.458333 -0.458333  0.291667    288.000000
 -0.375000 -0.458333  0.291667    576.000000
 -0.375000 -0.375000  0.291667    288.000000
  0.375000  0.375000  0.375000     96.000000
  0.458333  0.375000  0.375000    288.000000
 -0.458333  0.375000  0.375000    288.000000
 -0.375000  0.375000  0.375000    288.000000
  0.458333  0.458333  0.375000    288.000000
 -0.458333  0.458333  0.375000    576.000000
 -0.375000  0.458333  0.375000    576.000000
 -0.458333 -0.458333  0.375000    288.000000
  0.458333  0.458333  0.458333     96.000000
 -0.458333  0.458333  0.458333    288.000000
 
 Following cartesian coordinates:
            Coordinates               Weight
  0.011816  0.011816  0.011816     96.000000
 -0.011816  0.035448  0.035448    288.000000
 -0.035448  0.059080  0.059080    288.000000
 -0.059080  0.082711  0.082711    288.000000
 -0.082711  0.106343  0.106343    288.000000
 -0.106343  0.129975  0.129975    288.000000
  0.153607 -0.129975 -0.129975    288.000000
  0.129975 -0.106343 -0.106343    288.000000
  0.106343 -0.082711 -0.082711    288.000000
  0.082711 -0.059080 -0.059080    288.000000
  0.059080 -0.035448 -0.035448    288.000000
  0.035448 -0.011816 -0.011816    288.000000
  0.011816  0.011816  0.059080    288.000000
 -0.011816  0.035448  0.082711    576.000000
 -0.035448  0.059080  0.106343    576.000000
 -0.059080  0.082711  0.129975    576.000000
 -0.082711  0.106343  0.153607    576.000000
  0.177239 -0.153607 -0.106343    576.000000
  0.153607 -0.129975 -0.082711    576.000000
  0.129975 -0.106343 -0.059080    576.000000
  0.106343 -0.082711 -0.035448    576.000000
  0.082711 -0.059080 -0.011816    576.000000
  0.059080 -0.035448  0.011816    576.000000
  0.011816  0.011816  0.106343    288.000000
 -0.011816  0.035448  0.129975    576.000000
 -0.035448  0.059080  0.153607    576.000000
 -0.059080  0.082711  0.177239    576.000000
  0.200871 -0.177239 -0.082711    576.000000
  0.177239 -0.153607 -0.059080    576.000000
  0.153607 -0.129975 -0.035448    576.000000
  0.129975 -0.106343 -0.011816    576.000000
  0.106343 -0.082711  0.011816    576.000000
  0.082711 -0.059080  0.035448    576.000000
  0.011816  0.011816  0.153607    288.000000
 -0.011816  0.035448  0.177239    576.000000
 -0.035448  0.059080  0.200871    576.000000
  0.224503 -0.200871 -0.059080    576.000000
  0.200871 -0.177239 -0.035448    576.000000
  0.177239 -0.153607 -0.011816    576.000000
  0.153607 -0.129975  0.011816    576.000000
  0.129975 -0.106343  0.035448    576.000000
  0.106343 -0.082711  0.059080    576.000000
  0.011816  0.011816  0.200871    288.000000
 -0.011816  0.035448  0.224503    576.000000
  0.248134 -0.224503 -0.035448    576.000000
  0.224503 -0.200871 -0.011816    576.000000
  0.200871 -0.177239  0.011816    576.000000
  0.177239 -0.153607  0.035448    576.000000
  0.153607 -0.129975  0.059080    576.000000
  0.129975 -0.106343  0.082711    576.000000
  0.011816  0.011816  0.248134    288.000000
  0.271766 -0.248134 -0.011816    576.000000
  0.248134 -0.224503  0.011816    576.000000
  0.224503 -0.200871  0.035448    576.000000
  0.200871 -0.177239  0.059080    576.000000
  0.177239 -0.153607  0.082711    576.000000
  0.153607 -0.129975  0.106343    576.000000
  0.011816  0.011816 -0.271766    288.000000
 -0.011816  0.035448 -0.248134    576.000000
 -0.035448  0.059080 -0.224503    576.000000
 -0.059080  0.082711 -0.200871    576.000000
 -0.082711  0.106343 -0.177239    576.000000
  0.011816  0.011816 -0.224503    288.000000
 -0.011816  0.035448 -0.200871    576.000000
 -0.035448  0.059080 -0.177239    576.000000
 -0.059080  0.082711 -0.153607    576.000000
  0.011816  0.011816 -0.177239    288.000000
 -0.011816  0.035448 -0.153607    576.000000
 -0.035448  0.059080 -0.129975    576.000000
  0.011816  0.011816 -0.129975    288.000000
 -0.011816  0.035448 -0.106343    576.000000
  0.011816  0.011816 -0.082711    288.000000
  0.035448  0.035448  0.035448     96.000000
  0.011816  0.059080  0.059080    288.000000
 -0.011816  0.082711  0.082711    288.000000
 -0.035448  0.106343  0.106343    288.000000
 -0.059080  0.129975  0.129975    288.000000
  0.200871 -0.129975 -0.129975    288.000000
  0.177239 -0.106343 -0.106343    288.000000
  0.153607 -0.082711 -0.082711    288.000000
  0.129975 -0.059080 -0.059080    288.000000
  0.106343 -0.035448 -0.035448    288.000000
  0.035448  0.035448  0.082711    288.000000
  0.011816  0.059080  0.106343    576.000000
 -0.011816  0.082711  0.129975    576.000000
 -0.035448  0.106343  0.153607    576.000000
  0.224503 -0.153607 -0.106343    576.000000
  0.200871 -0.129975 -0.082711    576.000000
  0.177239 -0.106343 -0.059080    576.000000
  0.153607 -0.082711 -0.035448    576.000000
  0.129975 -0.059080 -0.011816    576.000000
  0.035448  0.035448  0.129975    288.000000
  0.011816  0.059080  0.153607    576.000000
 -0.011816  0.082711  0.177239    576.000000
  0.248134 -0.177239 -0.082711    576.000000
  0.224503 -0.153607 -0.059080    576.000000
  0.200871 -0.129975 -0.035448    576.000000
  0.177239 -0.106343 -0.011816    576.000000
  0.153607 -0.082711  0.011816    576.000000
  0.035448  0.035448  0.177239    288.000000
  0.011816  0.059080  0.200871    576.000000
  0.271766 -0.200871 -0.059080    576.000000
  0.248134 -0.177239 -0.035448    576.000000
  0.224503 -0.153607 -0.011816    576.000000
  0.200871 -0.129975  0.011816    576.000000
  0.177239 -0.106343  0.035448    576.000000
  0.035448  0.035448  0.224503    288.000000
  0.295398 -0.224503 -0.035448    576.000000
  0.271766 -0.200871 -0.011816    576.000000
  0.248134 -0.177239  0.011816    576.000000
  0.224503 -0.153607  0.035448    576.000000
  0.200871 -0.129975  0.059080    576.000000
  0.035448  0.035448 -0.295398    288.000000
  0.011816  0.059080 -0.271766    576.000000
 -0.011816  0.082711 -0.248134    576.000000
 -0.035448  0.106343 -0.224503    576.000000
  0.035448  0.035448 -0.248134    288.000000
  0.011816  0.059080 -0.224503    576.000000
 -0.011816  0.082711 -0.200871    576.000000
  0.035448  0.035448 -0.200871    288.000000
  0.011816  0.059080 -0.177239    576.000000
  0.035448  0.035448 -0.153607    288.000000
  0.059080  0.059080  0.059080     96.000000
  0.035448  0.082711  0.082711    288.000000
  0.011816  0.106343  0.106343    288.000000
 -0.011816  0.129975  0.129975    288.000000
  0.248134 -0.129975 -0.129975    288.000000
  0.224503 -0.106343 -0.106343    288.000000
  0.200871 -0.082711 -0.082711    288.000000
  0.177239 -0.059080 -0.059080    288.000000
  0.059080  0.059080  0.106343    288.000000
  0.035448  0.082711  0.129975    576.000000
  0.011816  0.106343  0.153607    576.000000
  0.271766 -0.153607 -0.106343    576.000000
  0.248134 -0.129975 -0.082711    576.000000
  0.224503 -0.106343 -0.059080    576.000000
  0.200871 -0.082711 -0.035448    576.000000
  0.059080  0.059080  0.153607    288.000000
  0.035448  0.082711  0.177239    576.000000
  0.295398 -0.177239 -0.082711    576.000000
  0.271766 -0.153607 -0.059080    576.000000
  0.248134 -0.129975 -0.035448    576.000000
  0.224503 -0.106343 -0.011816    576.000000
  0.059080  0.059080  0.200871    288.000000
  0.319030 -0.200871 -0.059080    576.000000
  0.295398 -0.177239 -0.035448    576.000000
  0.271766 -0.153607 -0.011816    576.000000
  0.248134 -0.129975  0.011816    576.000000
  0.059080  0.059080 -0.319030    288.000000
  0.035448  0.082711 -0.295398    576.000000
  0.011816  0.106343 -0.271766    576.000000
  0.059080  0.059080 -0.271766    288.000000
  0.035448  0.082711 -0.248134    576.000000
  0.059080  0.059080 -0.224503    288.000000
  0.082711  0.082711  0.082711     96.000000
  0.059080  0.106343  0.106343    288.000000
  0.035448  0.129975  0.129975    288.000000
  0.295398 -0.129975 -0.129975    288.000000
  0.271766 -0.106343 -0.106343    288.000000
  0.248134 -0.082711 -0.082711    288.000000
  0.082711  0.082711  0.129975    288.000000
  0.059080  0.106343  0.153607    576.000000
  0.319030 -0.153607 -0.106343    576.000000
  0.295398 -0.129975 -0.082711    576.000000
  0.271766 -0.106343 -0.059080    576.000000
  0.082711  0.082711  0.177239    288.000000
  0.342662 -0.177239 -0.082711    576.000000
  0.319030 -0.153607 -0.059080    576.000000
  0.295398 -0.129975 -0.035448    576.000000
  0.082711  0.082711 -0.342662    288.000000
  0.059080  0.106343 -0.319030    576.000000
  0.082711  0.082711 -0.295398    288.000000
  0.106343  0.106343  0.106343     96.000000
  0.082711  0.129975  0.129975    288.000000
  0.342662 -0.129975 -0.129975    288.000000
  0.319030 -0.106343 -0.106343    288.000000
  0.106343  0.106343  0.153607    288.000000
  0.366294 -0.153607 -0.106343    576.000000
  0.342662 -0.129975 -0.082711    576.000000
  0.106343  0.106343 -0.366294    288.000000
  0.129975  0.129975  0.129975     96.000000
  0.389926 -0.129975 -0.129975    288.000000
 

 ----------------------------------------------------------------------------- 
|                                                                             |
|           W    W    AA    RRRRR   N    N  II  N    N   GGGG   !!!           |
|           W    W   A  A   R    R  NN   N  II  NN   N  G    G  !!!           |
|           W    W  A    A  R    R  N N  N  II  N N  N  G       !!!           |
|           W WW W  AAAAAA  RRRRR   N  N N  II  N  N N  G  GGG   !            |
|           WW  WW  A    A  R   R   N   NN  II  N   NN  G    G                |
|           W    W  A    A  R    R  N    N  II  N    N   GGGG   !!!           |
|                                                                             |
|      Your generating k-point grid is not commensurate to the symmetry       |
|      of the lattice.  This can cause   slow convergence with respect        |
|      to k-points for HF type calculations                                   |
|      suggested SOLUTIONS:                                                   |
|       ) if not already the case, use automatic k-point generation           |
|       ) shift your grid to Gamma (G) (e.g. required for hex or fcc lattice) |
|                                                                             |
 ----------------------------------------------------------------------------- 

 
 Subroutine IBZKPT_HF returns following result:
 ==============================================
 
 Found   6912 k-points in 1st BZ
 the following   6912 k-points will be used (e.g. in the exchange kernel)
 Following reciprocal coordinates:   # in IRBZ
  0.041667  0.041667  0.041667    0.00014468   1 t-inv F
  0.125000  0.041667  0.041667    0.00014468   2 t-inv F
  0.208333  0.041667  0.041667    0.00014468   3 t-inv F
  0.291667  0.041667  0.041667    0.00014468   4 t-inv F
  0.375000  0.041667  0.041667    0.00014468   5 t-inv F
  0.458333  0.041667  0.041667    0.00014468   6 t-inv F
 -0.458333  0.041667  0.041667    0.00014468   7 t-inv F
 -0.375000  0.041667  0.041667    0.00014468   8 t-inv F
 -0.291667  0.041667  0.041667    0.00014468   9 t-inv F
 -0.208333  0.041667  0.041667    0.00014468  10 t-inv F
 -0.125000  0.041667  0.041667    0.00014468  11 t-inv F
 -0.041667  0.041667  0.041667    0.00014468  12 t-inv F
  0.125000  0.125000  0.041667    0.00014468  13 t-inv F
  0.208333  0.125000  0.041667    0.00014468  14 t-inv F
  0.291667  0.125000  0.041667    0.00014468  15 t-inv F
  0.375000  0.125000  0.041667    0.00014468  16 t-inv F
  0.458333  0.125000  0.041667    0.00014468  17 t-inv F
 -0.458333  0.125000  0.041667    0.00014468  18 t-inv F
 -0.375000  0.125000  0.041667    0.00014468  19 t-inv F
 -0.291667  0.125000  0.041667    0.00014468  20 t-inv F
 -0.208333  0.125000  0.041667    0.00014468  21 t-inv F
 -0.125000  0.125000  0.041667    0.00014468  22 t-inv F
 -0.041667  0.125000  0.041667    0.00014468  23 t-inv F
  0.208333  0.208333  0.041667    0.00014468  24 t-inv F
  0.291667  0.208333  0.041667    0.00014468  25 t-inv F
  0.375000  0.208333  0.041667    0.00014468  26 t-inv F
  0.458333  0.208333  0.041667    0.00014468  27 t-inv F
 -0.458333  0.208333  0.041667    0.00014468  28 t-inv F
 -0.375000  0.208333  0.041667    0.00014468  29 t-inv F
 -0.291667  0.208333  0.041667    0.00014468  30 t-inv F
 -0.208333  0.208333  0.041667    0.00014468  31 t-inv F
 -0.125000  0.208333  0.041667    0.00014468  32 t-inv F
 -0.041667  0.208333  0.041667    0.00014468  33 t-inv F
  0.291667  0.291667  0.041667    0.00014468  34 t-inv F
  0.375000  0.291667  0.041667    0.00014468  35 t-inv F
  0.458333  0.291667  0.041667    0.00014468  36 t-inv F
 -0.458333  0.291667  0.041667    0.00014468  37 t-inv F
 -0.375000  0.291667  0.041667    0.00014468  38 t-inv F
 -0.291667  0.291667  0.041667    0.00014468  39 t-inv F
 -0.208333  0.291667  0.041667    0.00014468  40 t-inv F
 -0.125000  0.291667  0.041667    0.00014468  41 t-inv F
 -0.041667  0.291667  0.041667    0.00014468  42 t-inv F
  0.375000  0.375000  0.041667    0.00014468  43 t-inv F
  0.458333  0.375000  0.041667    0.00014468  44 t-inv F
 -0.458333  0.375000  0.041667    0.00014468  45 t-inv F
 -0.375000  0.375000  0.041667    0.00014468  46 t-inv F
 -0.291667  0.375000  0.041667    0.00014468  47 t-inv F
 -0.208333  0.375000  0.041667    0.00014468  48 t-inv F
 -0.125000  0.375000  0.041667    0.00014468  49 t-inv F
 -0.041667  0.375000  0.041667    0.00014468  50 t-inv F
  0.458333  0.458333  0.041667    0.00014468  51 t-inv F
 -0.458333  0.458333  0.041667    0.00014468  52 t-inv F
 -0.375000  0.458333  0.041667    0.00014468  53 t-inv F
 -0.291667  0.458333  0.041667    0.00014468  54 t-inv F
 -0.208333  0.458333  0.041667    0.00014468  55 t-inv F
 -0.125000  0.458333  0.041667    0.00014468  56 t-inv F
 -0.041667  0.458333  0.041667    0.00014468  57 t-inv F
 -0.458333 -0.458333  0.041667    0.00014468  58 t-inv F
 -0.375000 -0.458333  0.041667    0.00014468  59 t-inv F
 -0.291667 -0.458333  0.041667    0.00014468  60 t-inv F
 -0.208333 -0.458333  0.041667    0.00014468  61 t-inv F
 -0.125000 -0.458333  0.041667    0.00014468  62 t-inv F
 -0.375000 -0.375000  0.041667    0.00014468  63 t-inv F
 -0.291667 -0.375000  0.041667    0.00014468  64 t-inv F
 -0.208333 -0.375000  0.041667    0.00014468  65 t-inv F
 -0.125000 -0.375000  0.041667    0.00014468  66 t-inv F
 -0.291667 -0.291667  0.041667    0.00014468  67 t-inv F
 -0.208333 -0.291667  0.041667    0.00014468  68 t-inv F
 -0.125000 -0.291667  0.041667    0.00014468  69 t-inv F
 -0.208333 -0.208333  0.041667    0.00014468  70 t-inv F
 -0.125000 -0.208333  0.041667    0.00014468  71 t-inv F
 -0.125000 -0.125000  0.041667    0.00014468  72 t-inv F
  0.125000  0.125000  0.125000    0.00014468  73 t-inv F
  0.208333  0.125000  0.125000    0.00014468  74 t-inv F
  0.291667  0.125000  0.125000    0.00014468  75 t-inv F
  0.375000  0.125000  0.125000    0.00014468  76 t-inv F
  0.458333  0.125000  0.125000    0.00014468  77 t-inv F
 -0.458333  0.125000  0.125000    0.00014468  78 t-inv F
 -0.375000  0.125000  0.125000    0.00014468  79 t-inv F
 -0.291667  0.125000  0.125000    0.00014468  80 t-inv F
 -0.208333  0.125000  0.125000    0.00014468  81 t-inv F
 -0.125000  0.125000  0.125000    0.00014468  82 t-inv F
  0.208333  0.208333  0.125000    0.00014468  83 t-inv F
  0.291667  0.208333  0.125000    0.00014468  84 t-inv F
  0.375000  0.208333  0.125000    0.00014468  85 t-inv F
  0.458333  0.208333  0.125000    0.00014468  86 t-inv F
 -0.458333  0.208333  0.125000    0.00014468  87 t-inv F
 -0.375000  0.208333  0.125000    0.00014468  88 t-inv F
 -0.291667  0.208333  0.125000    0.00014468  89 t-inv F
 -0.208333  0.208333  0.125000    0.00014468  90 t-inv F
 -0.125000  0.208333  0.125000    0.00014468  91 t-inv F
  0.291667  0.291667  0.125000    0.00014468  92 t-inv F
  0.375000  0.291667  0.125000    0.00014468  93 t-inv F
  0.458333  0.291667  0.125000    0.00014468  94 t-inv F
 -0.458333  0.291667  0.125000    0.00014468  95 t-inv F
 -0.375000  0.291667  0.125000    0.00014468  96 t-inv F
 -0.291667  0.291667  0.125000    0.00014468  97 t-inv F
 -0.208333  0.291667  0.125000    0.00014468  98 t-inv F
 -0.125000  0.291667  0.125000    0.00014468  99 t-inv F
  0.375000  0.375000  0.125000    0.00014468 100 t-inv F
  0.458333  0.375000  0.125000    0.00014468 101 t-inv F
 -0.458333  0.375000  0.125000    0.00014468 102 t-inv F
 -0.375000  0.375000  0.125000    0.00014468 103 t-inv F
 -0.291667  0.375000  0.125000    0.00014468 104 t-inv F
 -0.208333  0.375000  0.125000    0.00014468 105 t-inv F
 -0.125000  0.375000  0.125000    0.00014468 106 t-inv F
  0.458333  0.458333  0.125000    0.00014468 107 t-inv F
 -0.458333  0.458333  0.125000    0.00014468 108 t-inv F
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  0.000000 -0.458333 -0.083333    0.00014468 177 t-inv F
 -0.458333 -0.458333 -0.375000    0.00014468 177 t-inv F
 -0.375000 -0.458333 -0.458333    0.00014468 177 t-inv F
 -0.458333 -0.375000 -0.458333    0.00014468 177 t-inv F
  0.458333  0.083333  0.000000    0.00014468 177 t-inv F
  0.458333  0.000000  0.083333    0.00014468 177 t-inv F
  0.375000 -0.083333 -0.083333    0.00014468 177 t-inv F
 -0.083333 -0.083333  0.375000    0.00014468 177 t-inv F
  0.000000  0.083333  0.458333    0.00014468 177 t-inv F
  0.083333  0.000000  0.458333    0.00014468 177 t-inv F
  0.083333  0.458333  0.000000    0.00014468 177 t-inv F
 -0.083333  0.375000 -0.083333    0.00014468 177 t-inv F
  0.000000  0.458333  0.083333    0.00014468 177 t-inv F
  0.375000 -0.458333  0.458333    0.00014468 178 t-inv F
  0.458333  0.375000 -0.458333    0.00014468 178 t-inv F
 -0.458333 -0.083333 -0.916667    0.00014468 178 t-inv F
  0.458333  0.916667  0.833333    0.00014468 178 t-inv F
 -0.375000 -0.833333  0.083333    0.00014468 178 t-inv F
  0.083333 -0.833333 -0.375000    0.00014468 178 t-inv F
 -0.916667 -0.083333 -0.458333    0.00014468 178 t-inv F
  0.833333  0.916667  0.458333    0.00014468 178 t-inv F
  0.833333  0.458333  0.916667    0.00014468 178 t-inv F
  0.083333 -0.375000 -0.833333    0.00014468 178 t-inv F
 -0.916667 -0.458333 -0.083333    0.00014468 178 t-inv F
 -0.375000  0.083333 -0.833333    0.00014468 178 t-inv F
 -0.458333 -0.916667 -0.083333    0.00014468 178 t-inv F
  0.458333  0.833333  0.916667    0.00014468 178 t-inv F
  0.916667  0.833333  0.458333    0.00014468 178 t-inv F
 -0.833333  0.083333 -0.375000    0.00014468 178 t-inv F
 -0.083333 -0.916667 -0.458333    0.00014468 178 t-inv F
 -0.833333 -0.375000  0.083333    0.00014468 178 t-inv F
 -0.083333 -0.458333 -0.916667    0.00014468 178 t-inv F
  0.916667  0.458333  0.833333    0.00014468 178 t-inv F
 -0.458333  0.375000  0.458333    0.00014468 178 t-inv F
  0.458333 -0.458333  0.375000    0.00014468 178 t-inv F
  0.375000  0.458333 -0.458333    0.00014468 178 t-inv F
  0.458333 -0.458333 -0.375000    0.00014468 178 t-inv F
 -0.375000  0.458333 -0.458333    0.00014468 178 t-inv F
 -0.458333 -0.375000  0.458333    0.00014468 178 t-inv F
  0.458333  0.083333  0.916667    0.00014468 178 t-inv F
 -0.458333 -0.916667 -0.833333    0.00014468 178 t-inv F
  0.375000  0.833333 -0.083333    0.00014468 178 t-inv F
 -0.083333  0.833333  0.375000    0.00014468 178 t-inv F
  0.916667  0.083333  0.458333    0.00014468 178 t-inv F
 -0.833333 -0.916667 -0.458333    0.00014468 178 t-inv F
 -0.833333 -0.458333 -0.916667    0.00014468 178 t-inv F
 -0.083333  0.375000  0.833333    0.00014468 178 t-inv F
  0.916667  0.458333  0.083333    0.00014468 178 t-inv F
  0.375000 -0.083333  0.833333    0.00014468 178 t-inv F
  0.458333  0.916667  0.083333    0.00014468 178 t-inv F
 -0.458333 -0.833333 -0.916667    0.00014468 178 t-inv F
 -0.916667 -0.833333 -0.458333    0.00014468 178 t-inv F
  0.833333 -0.083333  0.375000    0.00014468 178 t-inv F
  0.083333  0.916667  0.458333    0.00014468 178 t-inv F
  0.833333  0.375000 -0.083333    0.00014468 178 t-inv F
  0.083333  0.458333  0.916667    0.00014468 178 t-inv F
 -0.916667 -0.458333 -0.833333    0.00014468 178 t-inv F
  0.458333 -0.375000 -0.458333    0.00014468 178 t-inv F
 -0.458333  0.458333 -0.375000    0.00014468 178 t-inv F
 -0.375000 -0.458333  0.458333    0.00014468 178 t-inv F
  0.375000 -0.375000  0.458333    0.00014468 179 t-inv F
  0.458333  0.375000 -0.375000    0.00014468 179 t-inv F
 -0.458333 -0.083333 -0.833333    0.00014468 179 t-inv F
  0.375000  0.833333  0.750000    0.00014468 179 t-inv F
 -0.375000 -0.750000  0.083333    0.00014468 179 t-inv F
  0.083333 -0.750000 -0.375000    0.00014468 179 t-inv F
 -0.833333 -0.083333 -0.458333    0.00014468 179 t-inv F
  0.750000  0.833333  0.375000    0.00014468 179 t-inv F
  0.750000  0.375000  0.833333    0.00014468 179 t-inv F
  0.083333 -0.375000 -0.750000    0.00014468 179 t-inv F
 -0.833333 -0.458333 -0.083333    0.00014468 179 t-inv F
 -0.375000  0.083333 -0.750000    0.00014468 179 t-inv F
 -0.458333 -0.833333 -0.083333    0.00014468 179 t-inv F
  0.375000  0.750000  0.833333    0.00014468 179 t-inv F
  0.833333  0.750000  0.375000    0.00014468 179 t-inv F
 -0.750000  0.083333 -0.375000    0.00014468 179 t-inv F
 -0.083333 -0.833333 -0.458333    0.00014468 179 t-inv F
 -0.750000 -0.375000  0.083333    0.00014468 179 t-inv F
 -0.083333 -0.458333 -0.833333    0.00014468 179 t-inv F
  0.833333  0.375000  0.750000    0.00014468 179 t-inv F
 -0.375000  0.375000  0.458333    0.00014468 179 t-inv F
  0.458333 -0.375000  0.375000    0.00014468 179 t-inv F
  0.375000  0.458333 -0.375000    0.00014468 179 t-inv F
  0.375000 -0.458333 -0.375000    0.00014468 179 t-inv F
 -0.375000  0.375000 -0.458333    0.00014468 179 t-inv F
 -0.458333 -0.375000  0.375000    0.00014468 179 t-inv F
  0.458333  0.083333  0.833333    0.00014468 179 t-inv F
 -0.375000 -0.833333 -0.750000    0.00014468 179 t-inv F
  0.375000  0.750000 -0.083333    0.00014468 179 t-inv F
 -0.083333  0.750000  0.375000    0.00014468 179 t-inv F
  0.833333  0.083333  0.458333    0.00014468 179 t-inv F
 -0.750000 -0.833333 -0.375000    0.00014468 179 t-inv F
 -0.750000 -0.375000 -0.833333    0.00014468 179 t-inv F
 -0.083333  0.375000  0.750000    0.00014468 179 t-inv F
  0.833333  0.458333  0.083333    0.00014468 179 t-inv F
  0.375000 -0.083333  0.750000    0.00014468 179 t-inv F
  0.458333  0.833333  0.083333    0.00014468 179 t-inv F
 -0.375000 -0.750000 -0.833333    0.00014468 179 t-inv F
 -0.833333 -0.750000 -0.375000    0.00014468 179 t-inv F
  0.750000 -0.083333  0.375000    0.00014468 179 t-inv F
  0.083333  0.833333  0.458333    0.00014468 179 t-inv F
  0.750000  0.375000 -0.083333    0.00014468 179 t-inv F
  0.083333  0.458333  0.833333    0.00014468 179 t-inv F
 -0.833333 -0.375000 -0.750000    0.00014468 179 t-inv F
  0.375000 -0.375000 -0.458333    0.00014468 179 t-inv F
 -0.458333  0.375000 -0.375000    0.00014468 179 t-inv F
 -0.375000 -0.458333  0.375000    0.00014468 179 t-inv F
  0.375000 -0.458333 -0.458333    0.00014468 180 t-inv F
 -0.458333  0.375000 -0.458333    0.00014468 180 t-inv F
  0.458333  0.833333  0.000000    0.00014468 180 t-inv F
  0.458333  0.000000  0.833333    0.00014468 180 t-inv F
 -0.375000 -0.833333 -0.833333    0.00014468 180 t-inv F
 -0.833333 -0.833333 -0.375000    0.00014468 180 t-inv F
  0.000000  0.833333  0.458333    0.00014468 180 t-inv F
  0.833333  0.000000  0.458333    0.00014468 180 t-inv F
  0.833333  0.458333  0.000000    0.00014468 180 t-inv F
 -0.833333 -0.375000 -0.833333    0.00014468 180 t-inv F
  0.000000  0.458333  0.833333    0.00014468 180 t-inv F
  0.458333  0.458333 -0.375000    0.00014468 180 t-inv F
 -0.375000  0.458333  0.458333    0.00014468 180 t-inv F
  0.458333 -0.375000  0.458333    0.00014468 180 t-inv F
 -0.458333 -0.833333  0.000000    0.00014468 180 t-inv F
 -0.458333  0.000000 -0.833333    0.00014468 180 t-inv F
  0.375000  0.833333  0.833333    0.00014468 180 t-inv F
  0.833333  0.833333  0.375000    0.00014468 180 t-inv F
  0.000000 -0.833333 -0.458333    0.00014468 180 t-inv F
 -0.833333  0.000000 -0.458333    0.00014468 180 t-inv F
 -0.833333 -0.458333  0.000000    0.00014468 180 t-inv F
  0.833333  0.375000  0.833333    0.00014468 180 t-inv F
  0.000000 -0.458333 -0.833333    0.00014468 180 t-inv F
 -0.458333  0.000000  0.000000    0.00014468 181 t-inv F
  0.000000  0.000000 -0.458333    0.00014468 181 t-inv F
  0.000000 -0.458333  0.000000    0.00014468 181 t-inv F
 -0.458333 -0.458333 -0.458333    0.00014468 181 t-inv F
  0.458333  0.000000  0.000000    0.00014468 181 t-inv F
  0.000000  0.000000  0.458333    0.00014468 181 t-inv F
  0.000000  0.458333  0.000000    0.00014468 181 t-inv F
  0.458333 -0.458333  0.458333    0.00014468 182 t-inv F
  0.458333  0.458333 -0.458333    0.00014468 182 t-inv F
 -0.458333  0.000000 -0.916667    0.00014468 182 t-inv F
  0.458333  0.916667  0.916667    0.00014468 182 t-inv F
 -0.458333 -0.916667 -0.000000    0.00014468 182 t-inv F
 -0.000000 -0.916667 -0.458333    0.00014468 182 t-inv F
 -0.916667  0.000000 -0.458333    0.00014468 182 t-inv F
  0.916667  0.916667  0.458333    0.00014468 182 t-inv F
  0.916667  0.458333  0.916667    0.00014468 182 t-inv F
 -0.000000 -0.458333 -0.916667    0.00014468 182 t-inv F
 -0.916667 -0.458333  0.000000    0.00014468 182 t-inv F
  0.458333 -0.458333 -0.458333    0.00014468 182 t-inv F
 -0.458333  0.458333 -0.458333    0.00014468 182 t-inv F
 -0.458333 -0.458333  0.458333    0.00014468 182 t-inv F
  0.458333 -0.000000  0.916667    0.00014468 182 t-inv F
 -0.458333 -0.916667 -0.916667    0.00014468 182 t-inv F
  0.458333  0.916667  0.000000    0.00014468 182 t-inv F
  0.000000  0.916667  0.458333    0.00014468 182 t-inv F
  0.916667 -0.000000  0.458333    0.00014468 182 t-inv F
 -0.916667 -0.916667 -0.458333    0.00014468 182 t-inv F
 -0.916667 -0.458333 -0.916667    0.00014468 182 t-inv F
  0.000000  0.458333  0.916667    0.00014468 182 t-inv F
  0.916667  0.458333 -0.000000    0.00014468 182 t-inv F


--------------------------------------------------------------------------------------------------------




 Dimension of arrays:
   k-points           NKPTS =    182   k-points in BZ     NKDIM =    182   number of bands    NBANDS=     20
   number of dos      NEDOS =    301   number of ions     NIONS =      2
   non local maximal  LDIM  =      4   non local SUM 2l+1 LMDIM =      8
   total plane-waves  NPLWV =   4096
   max r-space proj   IRMAX =      1   max aug-charges    IRDMAX=   4608
   dimension x,y,z NGX =    16 NGY =   16 NGZ =   16
   dimension x,y,z NGXF=    32 NGYF=   32 NGZF=   32
   support grid    NGXF=    32 NGYF=   32 NGZF=   32
   ions per type =               2
 NGX,Y,Z   is equivalent  to a cutoff of  10.67, 10.67, 10.67 a.u.
 NGXF,Y,Z  is equivalent  to a cutoff of  21.34, 21.34, 21.34 a.u.


 I would recommend the setting:
   dimension x,y,z NGX =    16 NGY =   16 NGZ =   16
 SYSTEM =  Diamond                                 
 POSCAR =  cif to poscar ['C']                     

 Startparameter for this run:
   NWRITE =      2    write-flag & timer
   PREC   = accura    normal or accurate (medium, high low for compatibility)
   ISTART =      0    job   : 0-new  1-cont  2-samecut
   ICHARG =      2    charge: 1-file 2-atom 10-const
   ISPIN  =      1    spin polarized calculation?
   LNONCOLLINEAR =      F non collinear calculations
   LSORBIT =      F    spin-orbit coupling
   INIWAV =      1    electr: 0-lowe 1-rand  2-diag
   LASPH  =      F    aspherical Exc in radial PAW
   METAGGA=      F    non-selfconsistent MetaGGA calc.

 Electronic Relaxation 1
   ENCUT  =  400.0 eV  29.40 Ry    5.42 a.u.   4.07  4.07  4.07*2*pi/ulx,y,z
   ENINI  =  400.0     initial cutoff
   ENAUG  =  644.9 eV  augmentation charge cutoff
   NELM   =     24;   NELMIN=  2; NELMDL= -5     # of ELM steps 
   EDIFF  = 0.1E-07   stopping-criterion for ELM
   LREAL  =      F    real-space projection
   NLSPLINE    = F    spline interpolate recip. space projectors
   LCOMPAT=      F    compatible to vasp.4.4
   GGA_COMPAT  = T    GGA compatible to vasp.4.4-vasp.4.6
   LMAXPAW     = -100 max onsite density
   LMAXMIX     =    2 max onsite mixed and CHGCAR
   VOSKOWN=      0    Vosko Wilk Nusair interpolation
   ROPT   =    0.00000
 Ionic relaxation
   EDIFFG = -.2E-01   stopping-criterion for IOM
   NSW    =      1    number of steps for IOM
   NBLOCK =      1;   KBLOCK =      1    inner block; outer block 
   IBRION =      8    ionic relax: 0-MD 1-quasi-New 2-CG
   NFREE  =      0    steps in history (QN), initial steepest desc. (CG)
   ISIF   =      3    stress and relaxation
   IWAVPR =     11    prediction:  0-non 1-charg 2-wave 3-comb
   ISYM   =      1    0-nonsym 1-usesym 2-fastsym
   LCORR  =      T    Harris-Foulkes like correction to forces

   POTIM  = 0.5000    time-step for ionic-motion
   TEIN   =    0.0    initial temperature
   TEBEG  =    0.0;   TEEND  =   0.0 temperature during run
   SMASS  =  -3.00    Nose mass-parameter (am)
   estimated Nose-frequenzy (Omega)   =  0.10E-29 period in steps =****** mass=  -0.142E-27a.u.
   SCALEE = 1.0000    scale energy and forces
   NPACO  =    256;   APACO  = 16.0  distance and # of slots for P.C.
   PSTRESS=    0.0 pullay stress

  Mass of Ions in am
   POMASS =  12.01
  Ionic Valenz
   ZVAL   =   4.00
  Atomic Wigner-Seitz radii
   RWIGS  =  -1.00
  virtual crystal weights 
   VCA    =   1.00
   NELECT =       8.0000    total number of electrons
   NUPDOWN=      -1.0000    fix difference up-down

 DOS related values:
   EMIN   =  10.00;   EMAX   =-10.00  energy-range for DOS
   EFERMI =   0.00
   ISMEAR =     0;   SIGMA  =   0.05  broadening in eV -4-tet -1-fermi 0-gaus

 Electronic relaxation 2 (details)
   IALGO  =     68    algorithm
   LDIAG  =      T    sub-space diagonalisation (order eigenvalues)
   LSUBROT=      F    optimize rotation matrix (better conditioning)
   TURBO    =      0    0=normal 1=particle mesh
   IRESTART =      0    0=no restart 2=restart with 2 vectors
   NREBOOT  =      0    no. of reboots
   NMIN     =      0    reboot dimension
   EREF     =   0.00    reference energy to select bands
   IMIX   =      4    mixing-type and parameters
     AMIX     =   0.40;   BMIX     =  1.00
     AMIX_MAG =   1.60;   BMIX_MAG =  1.00
     AMIN     =   0.10
     WC   =   100.;   INIMIX=   1;  MIXPRE=   1;  MAXMIX= -45

 Intra band minimization:
   WEIMIN = 0.0010     energy-eigenvalue tresh-hold
   EBREAK =  0.13E-09  absolut break condition
   DEPER  =   0.30     relativ break condition  

   TIME   =   0.40     timestep for ELM

  volume/ion in A,a.u.               =       5.48        36.99
  Fermi-wavevector in a.u.,A,eV,Ry     =   1.473909  2.785283 29.557383  2.172406
  Thomas-Fermi vector in A             =   2.588744
 
 Write flags
   LWAVE  =      F    write WAVECAR
   LCHARG =      T    write CHGCAR
   LVTOT  =      F    write LOCPOT, total local potential
   LVHAR  =      F    write LOCPOT, Hartree potential only
   LELF   =      F    write electronic localiz. function (ELF)
   LORBIT =     11    0 simple, 1 ext, 2 COOP (PROOUT)


 Dipole corrections
   LMONO  =      F    monopole corrections only (constant potential shift)
   LDIPOL =      F    correct potential (dipole corrections)
   IDIPOL =      0    1-x, 2-y, 3-z, 4-all directions 
   EPSILON=  1.0000000 bulk dielectric constant

 Exchange correlation treatment:
   GGA     =    --    GGA type
   LEXCH   =     2    internal setting for exchange type
   VOSKOWN=      0    Vosko Wilk Nusair interpolation
   LHFCALC =     F    Hartree Fock is set to
   LHFONE  =     F    Hartree Fock one center treatment
   AEXX    =    0.0000 exact exchange contribution

 Linear response parameters
   LEPSILON=     T    determine dielectric tensor
   LRPA    =     F    only Hartree local field effects (RPA)
   LNABLA  =     F    use nabla operator in PAW spheres
   LVEL    =     F    velocity operator in full k-point grid
   LINTERFAST=   F  fast interpolation
   KINTER  =     0    interpolate to denser k-point grid
   CSHIFT  =0.1000    complex shift for real part using Kramers Kronig
   OMEGAMAX=  -1.0    maximum frequency
   DEG_THRESHOLD= 0.2000000E-02 threshold for treating states as degnerate
   RTIME   =    0.100 relaxation time in fs

 Orbital magnetization related:
   ORBITALMAG=     F  switch on orbital magnetization
   LCHIMAG   =     F  perturbation theory with respect to B field
   DQ        =  0.001000  dq finite difference perturbation B field



--------------------------------------------------------------------------------------------------------


 linear response using symmetry
   using selective dynamics as specified on POSCAR
 charge density and potential will be updated during run
 non-spin polarized calculation
 RMM-DIIS sequential band-by-band and
  variant of blocked Davidson during initial phase
 perform sub-space diagonalisation
    before iterative eigenvector-optimisation
 modified Broyden-mixing scheme, WC =      100.0
 initial mixing is a Kerker type mixing with AMIX =  0.4000 and BMIX =      1.0000
 Hartree-type preconditioning will be used
 using additional bands           16
 reciprocal scheme for non local part
 use partial core corrections
 calculate Harris-corrections to forces 
   (improved forces if not selfconsistent)
 use of overlap-Matrix (Vanderbilt PP)
 Gauss-broadening in eV      SIGMA  =   0.05


--------------------------------------------------------------------------------------------------------


  energy-cutoff  :      400.00
  volume of cell :       10.96
      direct lattice vectors                 reciprocal lattice vectors
     0.000000000  1.763156895  1.763156895    -0.283582250  0.283582250  0.283582250
     1.763156895  0.000000000  1.763156895     0.283582250 -0.283582250  0.283582250
     1.763156895  1.763156895  0.000000000     0.283582250  0.283582250 -0.283582250

  length of vectors
     2.493480393  2.493480393  2.493480393     0.491178866  0.491178866  0.491178866


 
 k-points in units of 2pi/SCALE and weight: Auto k-point                            
   0.01181593  0.01181593  0.01181593       0.001
  -0.01181593  0.03544778  0.03544778       0.003
  -0.03544778  0.05907964  0.05907964       0.003
  -0.05907964  0.08271149  0.08271149       0.003
  -0.08271149  0.10634334  0.10634334       0.003
  -0.10634334  0.12997520  0.12997520       0.003
   0.15360705 -0.12997520 -0.12997520       0.003
   0.12997520 -0.10634334 -0.10634334       0.003
   0.10634334 -0.08271149 -0.08271149       0.003
   0.08271149 -0.05907964 -0.05907964       0.003
   0.05907964 -0.03544778 -0.03544778       0.003
   0.03544778 -0.01181593 -0.01181593       0.003
   0.01181593  0.01181593  0.05907964       0.003
  -0.01181593  0.03544778  0.08271149       0.007
  -0.03544778  0.05907964  0.10634334       0.007
  -0.05907964  0.08271149  0.12997520       0.007
  -0.08271149  0.10634334  0.15360705       0.007
   0.17723891 -0.15360705 -0.10634334       0.007
   0.15360705 -0.12997520 -0.08271149       0.007
   0.12997520 -0.10634334 -0.05907964       0.007
   0.10634334 -0.08271149 -0.03544778       0.007
   0.08271149 -0.05907964 -0.01181593       0.007
   0.05907964 -0.03544778  0.01181593       0.007
   0.01181593  0.01181593  0.10634334       0.003
  -0.01181593  0.03544778  0.12997520       0.007
  -0.03544778  0.05907964  0.15360705       0.007
  -0.05907964  0.08271149  0.17723891       0.007
   0.20087076 -0.17723891 -0.08271149       0.007
   0.17723891 -0.15360705 -0.05907964       0.007
   0.15360705 -0.12997520 -0.03544778       0.007
   0.12997520 -0.10634334 -0.01181593       0.007
   0.10634334 -0.08271149  0.01181593       0.007
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   0.22450261 -0.20087076 -0.05907964       0.007
   0.20087076 -0.17723891 -0.03544778       0.007
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   0.17723891 -0.15360705  0.03544778       0.007
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   0.17723891 -0.15360705  0.08271149       0.007
   0.15360705 -0.12997520  0.10634334       0.007
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  -0.05907964  0.08271149 -0.15360705       0.007
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  -0.01181593  0.03544778 -0.15360705       0.007
  -0.03544778  0.05907964 -0.12997520       0.007
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  -0.01181593  0.03544778 -0.10634334       0.007
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   0.03544778  0.03544778  0.03544778       0.001
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   0.24813447 -0.17723891  0.01181593       0.007
   0.22450261 -0.15360705  0.03544778       0.007
   0.20087076 -0.12997520  0.05907964       0.007
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  -0.01181593  0.08271149 -0.24813447       0.007
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  -0.01181593  0.08271149 -0.20087076       0.007
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  -0.01181593  0.12997520  0.12997520       0.003
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   0.20087076 -0.08271149 -0.08271149       0.003
   0.17723891 -0.05907964 -0.05907964       0.003
   0.05907964  0.05907964  0.10634334       0.003
   0.03544778  0.08271149  0.12997520       0.007
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   0.08271149  0.08271149  0.08271149       0.001
   0.05907964  0.10634334  0.10634334       0.003
   0.03544778  0.12997520  0.12997520       0.003
   0.29539818 -0.12997520 -0.12997520       0.003
   0.27176632 -0.10634334 -0.10634334       0.003
   0.24813447 -0.08271149 -0.08271149       0.003
   0.08271149  0.08271149  0.12997520       0.003
   0.05907964  0.10634334  0.15360705       0.007
   0.31903003 -0.15360705 -0.10634334       0.007
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   0.27176632 -0.10634334 -0.05907964       0.007
   0.08271149  0.08271149  0.17723891       0.003
   0.34266189 -0.17723891 -0.08271149       0.007
   0.31903003 -0.15360705 -0.05907964       0.007
   0.29539818 -0.12997520 -0.03544778       0.007
   0.08271149  0.08271149 -0.34266189       0.003
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   0.08271149  0.08271149 -0.29539818       0.003
   0.10634334  0.10634334  0.10634334       0.001
   0.08271149  0.12997520  0.12997520       0.003
   0.34266189 -0.12997520 -0.12997520       0.003
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   0.36629374 -0.15360705 -0.10634334       0.007
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   0.10634334  0.10634334 -0.36629374       0.003
   0.12997520  0.12997520  0.12997520       0.001
   0.38992559 -0.12997520 -0.12997520       0.003
 
 k-points in reciprocal lattice and weights: Auto k-point                            
   0.04166667  0.04166667  0.04166667       0.001
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  -0.37500000  0.45833333  0.12500000       0.007
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   0.37500000  0.37500000  0.29166667       0.003
   0.45833333  0.37500000  0.29166667       0.007
  -0.45833333  0.37500000  0.29166667       0.007
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  -0.29166667  0.37500000  0.29166667       0.007
   0.45833333  0.45833333  0.29166667       0.003
  -0.45833333  0.45833333  0.29166667       0.007
  -0.37500000  0.45833333  0.29166667       0.007
  -0.29166667  0.45833333  0.29166667       0.007
  -0.45833333 -0.45833333  0.29166667       0.003
  -0.37500000 -0.45833333  0.29166667       0.007
  -0.37500000 -0.37500000  0.29166667       0.003
   0.37500000  0.37500000  0.37500000       0.001
   0.45833333  0.37500000  0.37500000       0.003
  -0.45833333  0.37500000  0.37500000       0.003
  -0.37500000  0.37500000  0.37500000       0.003
   0.45833333  0.45833333  0.37500000       0.003
  -0.45833333  0.45833333  0.37500000       0.007
  -0.37500000  0.45833333  0.37500000       0.007
  -0.45833333 -0.45833333  0.37500000       0.003
   0.45833333  0.45833333  0.45833333       0.001
  -0.45833333  0.45833333  0.45833333       0.003
 
 position of ions in fractional coordinates (direct lattice) 
   0.00000000  0.00000000  0.00000000
   0.25000000  0.25000000  0.25000000
 
 position of ions in cartesian coordinates  (Angst):
   0.00000000  0.00000000  0.00000000
   0.88157845  0.88157845  0.88157845
 


--------------------------------------------------------------------------------------------------------


 k-point  1 :   0.0417 0.0417 0.0417  plane waves:     181
 k-point  2 :   0.1250 0.0417 0.0417  plane waves:     180
 k-point  3 :   0.2083 0.0417 0.0417  plane waves:     193
 k-point  4 :   0.2917 0.0417 0.0417  plane waves:     198
 k-point  5 :   0.3750 0.0417 0.0417  plane waves:     200
 k-point  6 :   0.4583 0.0417 0.0417  plane waves:     197
 k-point  7 :  -0.4583 0.0417 0.0417  plane waves:     200
 k-point  8 :  -0.3750 0.0417 0.0417  plane waves:     197
 k-point  9 :  -0.2917 0.0417 0.0417  plane waves:     200
 k-point 10 :  -0.2083 0.0417 0.0417  plane waves:     196
 k-point 11 :  -0.1250 0.0417 0.0417  plane waves:     190
 k-point 12 :  -0.0417 0.0417 0.0417  plane waves:     179
 k-point 13 :   0.1250 0.1250 0.0417  plane waves:     181
 k-point 14 :   0.2083 0.1250 0.0417  plane waves:     192
 k-point 15 :   0.2917 0.1250 0.0417  plane waves:     196
 k-point 16 :   0.3750 0.1250 0.0417  plane waves:     199
 k-point 17 :   0.4583 0.1250 0.0417  plane waves:     200
 k-point 18 :  -0.4583 0.1250 0.0417  plane waves:     199
 k-point 19 :  -0.3750 0.1250 0.0417  plane waves:     199
 k-point 20 :  -0.2917 0.1250 0.0417  plane waves:     198
 k-point 21 :  -0.2083 0.1250 0.0417  plane waves:     198
 k-point 22 :  -0.1250 0.1250 0.0417  plane waves:     193
 k-point 23 :  -0.0417 0.1250 0.0417  plane waves:     184
 k-point 24 :   0.2083 0.2083 0.0417  plane waves:     194
 k-point 25 :   0.2917 0.2083 0.0417  plane waves:     197
 k-point 26 :   0.3750 0.2083 0.0417  plane waves:     199
 k-point 27 :   0.4583 0.2083 0.0417  plane waves:     199
 k-point 28 :  -0.4583 0.2083 0.0417  plane waves:     198
 k-point 29 :  -0.3750 0.2083 0.0417  plane waves:     199
 k-point 30 :  -0.2917 0.2083 0.0417  plane waves:     201
 k-point 31 :  -0.2083 0.2083 0.0417  plane waves:     202
 k-point 32 :  -0.1250 0.2083 0.0417  plane waves:     198
 k-point 33 :  -0.0417 0.2083 0.0417  plane waves:     194
 k-point 34 :   0.2917 0.2917 0.0417  plane waves:     202
 k-point 35 :   0.3750 0.2917 0.0417  plane waves:     201
 k-point 36 :   0.4583 0.2917 0.0417  plane waves:     202
 k-point 37 :  -0.4583 0.2917 0.0417  plane waves:     199
 k-point 38 :  -0.3750 0.2917 0.0417  plane waves:     201
 k-point 39 :  -0.2917 0.2917 0.0417  plane waves:     199
 k-point 40 :  -0.2083 0.2917 0.0417  plane waves:     198
 k-point 41 :  -0.1250 0.2917 0.0417  plane waves:     199
 k-point 42 :  -0.0417 0.2917 0.0417  plane waves:     199
 k-point 43 :   0.3750 0.3750 0.0417  plane waves:     202
 k-point 44 :   0.4583 0.3750 0.0417  plane waves:     204
 k-point 45 :  -0.4583 0.3750 0.0417  plane waves:     203
 k-point 46 :  -0.3750 0.3750 0.0417  plane waves:     201
 k-point 47 :  -0.2917 0.3750 0.0417  plane waves:     198
 k-point 48 :  -0.2083 0.3750 0.0417  plane waves:     200
 k-point 49 :  -0.1250 0.3750 0.0417  plane waves:     198
 k-point 50 :  -0.0417 0.3750 0.0417  plane waves:     197
 k-point 51 :   0.4583 0.4583 0.0417  plane waves:     201
 k-point 52 :  -0.4583 0.4583 0.0417  plane waves:     202
 k-point 53 :  -0.3750 0.4583 0.0417  plane waves:     203
 k-point 54 :  -0.2917 0.4583 0.0417  plane waves:     201
 k-point 55 :  -0.2083 0.4583 0.0417  plane waves:     199
 k-point 56 :  -0.1250 0.4583 0.0417  plane waves:     199
 k-point 57 :  -0.0417 0.4583 0.0417  plane waves:     197
 k-point 58 :  -0.4583-0.4583 0.0417  plane waves:     198
 k-point 59 :  -0.3750-0.4583 0.0417  plane waves:     203
 k-point 60 :  -0.2917-0.4583 0.0417  plane waves:     203
 k-point 61 :  -0.2083-0.4583 0.0417  plane waves:     198
 k-point 62 :  -0.1250-0.4583 0.0417  plane waves:     197
 k-point 63 :  -0.3750-0.3750 0.0417  plane waves:     202
 k-point 64 :  -0.2917-0.3750 0.0417  plane waves:     204
 k-point 65 :  -0.2083-0.3750 0.0417  plane waves:     197
 k-point 66 :  -0.1250-0.3750 0.0417  plane waves:     199
 k-point 67 :  -0.2917-0.2917 0.0417  plane waves:     202
 k-point 68 :  -0.2083-0.2917 0.0417  plane waves:     201
 k-point 69 :  -0.1250-0.2917 0.0417  plane waves:     198
 k-point 70 :  -0.2083-0.2083 0.0417  plane waves:     202
 k-point 71 :  -0.1250-0.2083 0.0417  plane waves:     194
 k-point 72 :  -0.1250-0.1250 0.0417  plane waves:     190
 k-point 73 :   0.1250 0.1250 0.1250  plane waves:     184
 k-point 74 :   0.2083 0.1250 0.1250  plane waves:     188
 k-point 75 :   0.2917 0.1250 0.1250  plane waves:     196
 k-point 76 :   0.3750 0.1250 0.1250  plane waves:     200
 k-point 77 :   0.4583 0.1250 0.1250  plane waves:     199
 k-point 78 :  -0.4583 0.1250 0.1250  plane waves:     201
 k-point 79 :  -0.3750 0.1250 0.1250  plane waves:     199
 k-point 80 :  -0.2917 0.1250 0.1250  plane waves:     200
 k-point 81 :  -0.2083 0.1250 0.1250  plane waves:     198
 k-point 82 :  -0.1250 0.1250 0.1250  plane waves:     196
 k-point 83 :   0.2083 0.2083 0.1250  plane waves:     192
 k-point 84 :   0.2917 0.2083 0.1250  plane waves:     197
 k-point 85 :   0.3750 0.2083 0.1250  plane waves:     201
 k-point 86 :   0.4583 0.2083 0.1250  plane waves:     200
 k-point 87 :  -0.4583 0.2083 0.1250  plane waves:     200
 k-point 88 :  -0.3750 0.2083 0.1250  plane waves:     197
 k-point 89 :  -0.2917 0.2083 0.1250  plane waves:     199
 k-point 90 :  -0.2083 0.2083 0.1250  plane waves:     199
 k-point 91 :  -0.1250 0.2083 0.1250  plane waves:     197
 k-point 92 :   0.2917 0.2917 0.1250  plane waves:     196
 k-point 93 :   0.3750 0.2917 0.1250  plane waves:     199
 k-point 94 :   0.4583 0.2917 0.1250  plane waves:     201
 k-point 95 :  -0.4583 0.2917 0.1250  plane waves:     197
 k-point 96 :  -0.3750 0.2917 0.1250  plane waves:     199
 k-point 97 :  -0.2917 0.2917 0.1250  plane waves:     198
 k-point 98 :  -0.2083 0.2917 0.1250  plane waves:     200
 k-point 99 :  -0.1250 0.2917 0.1250  plane waves:     200
 k-point ** :   0.3750 0.3750 0.1250  plane waves:     200
 k-point ** :   0.4583 0.3750 0.1250  plane waves:     202
 k-point ** :  -0.4583 0.3750 0.1250  plane waves:     202
 k-point ** :  -0.3750 0.3750 0.1250  plane waves:     201
 k-point ** :  -0.2917 0.3750 0.1250  plane waves:     200
 k-point ** :  -0.2083 0.3750 0.1250  plane waves:     200
 k-point ** :  -0.1250 0.3750 0.1250  plane waves:     199
 k-point ** :   0.4583 0.4583 0.1250  plane waves:     203
 k-point ** :  -0.4583 0.4583 0.1250  plane waves:     203
 k-point ** :  -0.3750 0.4583 0.1250  plane waves:     204
 k-point ** :  -0.2917 0.4583 0.1250  plane waves:     203
 k-point ** :  -0.2083 0.4583 0.1250  plane waves:     202
 k-point ** :  -0.1250 0.4583 0.1250  plane waves:     197
 k-point ** :  -0.4583-0.4583 0.1250  plane waves:     202
 k-point ** :  -0.3750-0.4583 0.1250  plane waves:     204
 k-point ** :  -0.2917-0.4583 0.1250  plane waves:     202
 k-point ** :  -0.2083-0.4583 0.1250  plane waves:     201
 k-point ** :  -0.3750-0.3750 0.1250  plane waves:     203
 k-point ** :  -0.2917-0.3750 0.1250  plane waves:     202
 k-point ** :  -0.2083-0.3750 0.1250  plane waves:     199
 k-point ** :  -0.2917-0.2917 0.1250  plane waves:     203
 k-point ** :  -0.2083-0.2917 0.1250  plane waves:     200
 k-point ** :  -0.2083-0.2083 0.1250  plane waves:     197
 k-point ** :   0.2083 0.2083 0.2083  plane waves:     193
 k-point ** :   0.2917 0.2083 0.2083  plane waves:     196
 k-point ** :   0.3750 0.2083 0.2083  plane waves:     200
 k-point ** :   0.4583 0.2083 0.2083  plane waves:     199
 k-point ** :  -0.4583 0.2083 0.2083  plane waves:     198
 k-point ** :  -0.3750 0.2083 0.2083  plane waves:     202
 k-point ** :  -0.2917 0.2083 0.2083  plane waves:     197
 k-point ** :  -0.2083 0.2083 0.2083  plane waves:     196
 k-point ** :   0.2917 0.2917 0.2083  plane waves:     196
 k-point ** :   0.3750 0.2917 0.2083  plane waves:     199
 k-point ** :   0.4583 0.2917 0.2083  plane waves:     200
 k-point ** :  -0.4583 0.2917 0.2083  plane waves:     199
 k-point ** :  -0.3750 0.2917 0.2083  plane waves:     200
 k-point ** :  -0.2917 0.2917 0.2083  plane waves:     201
 k-point ** :  -0.2083 0.2917 0.2083  plane waves:     198
 k-point ** :   0.3750 0.3750 0.2083  plane waves:     198
 k-point ** :   0.4583 0.3750 0.2083  plane waves:     198
 k-point ** :  -0.4583 0.3750 0.2083  plane waves:     201
 k-point ** :  -0.3750 0.3750 0.2083  plane waves:     200
 k-point ** :  -0.2917 0.3750 0.2083  plane waves:     201
 k-point ** :  -0.2083 0.3750 0.2083  plane waves:     200
 k-point ** :   0.4583 0.4583 0.2083  plane waves:     199
 k-point ** :  -0.4583 0.4583 0.2083  plane waves:     200
 k-point ** :  -0.3750 0.4583 0.2083  plane waves:     201
 k-point ** :  -0.2917 0.4583 0.2083  plane waves:     203
 k-point ** :  -0.2083 0.4583 0.2083  plane waves:     203
 k-point ** :  -0.4583-0.4583 0.2083  plane waves:     200
 k-point ** :  -0.3750-0.4583 0.2083  plane waves:     202
 k-point ** :  -0.2917-0.4583 0.2083  plane waves:     204
 k-point ** :  -0.3750-0.3750 0.2083  plane waves:     202
 k-point ** :  -0.2917-0.3750 0.2083  plane waves:     202
 k-point ** :  -0.2917-0.2917 0.2083  plane waves:     201
 k-point ** :   0.2917 0.2917 0.2917  plane waves:     199
 k-point ** :   0.3750 0.2917 0.2917  plane waves:     195
 k-point ** :   0.4583 0.2917 0.2917  plane waves:     199
 k-point ** :  -0.4583 0.2917 0.2917  plane waves:     198
 k-point ** :  -0.3750 0.2917 0.2917  plane waves:     198
 k-point ** :  -0.2917 0.2917 0.2917  plane waves:     200
 k-point ** :   0.3750 0.3750 0.2917  plane waves:     196
 k-point ** :   0.4583 0.3750 0.2917  plane waves:     199
 k-point ** :  -0.4583 0.3750 0.2917  plane waves:     200
 k-point ** :  -0.3750 0.3750 0.2917  plane waves:     200
 k-point ** :  -0.2917 0.3750 0.2917  plane waves:     201
 k-point ** :   0.4583 0.4583 0.2917  plane waves:     200
 k-point ** :  -0.4583 0.4583 0.2917  plane waves:     199
 k-point ** :  -0.3750 0.4583 0.2917  plane waves:     199
 k-point ** :  -0.2917 0.4583 0.2917  plane waves:     204
 k-point ** :  -0.4583-0.4583 0.2917  plane waves:     202
 k-point ** :  -0.3750-0.4583 0.2917  plane waves:     201
 k-point ** :  -0.3750-0.3750 0.2917  plane waves:     198
 k-point ** :   0.3750 0.3750 0.3750  plane waves:     198
 k-point ** :   0.4583 0.3750 0.3750  plane waves:     196
 k-point ** :  -0.4583 0.3750 0.3750  plane waves:     201
 k-point ** :  -0.3750 0.3750 0.3750  plane waves:     204
 k-point ** :   0.4583 0.4583 0.3750  plane waves:     199
 k-point ** :  -0.4583 0.4583 0.3750  plane waves:     200
 k-point ** :  -0.3750 0.4583 0.3750  plane waves:     198
 k-point ** :  -0.4583-0.4583 0.3750  plane waves:     199
 k-point ** :   0.4583 0.4583 0.4583  plane waves:     201
 k-point ** :  -0.4583 0.4583 0.4583  plane waves:     201

 maximum and minimum number of plane-waves per node :       204      179

 maximum number of plane-waves:       204
 maximum index in each direction: 
   IXMAX=    4   IYMAX=    4   IZMAX=    4
   IXMIN=   -4   IYMIN=   -4   IZMIN=   -4

 WARNING: aliasing errors must be expected set NGX to  18 to avoid them
 WARNING: aliasing errors must be expected set NGY to  18 to avoid them
 WARNING: aliasing errors must be expected set NGZ to  18 to avoid them
 aliasing errors are usually negligible using standard VASP settings
 and one can safely disregard these warnings

 serial   3D FFT for wavefunctions
 parallel 3D FFT for charge:
    minimum data exchange during FFTs selected (reduces bandwidth)


 total amount of memory used by VASP on root node    33632. kBytes
========================================================================

   base      :      30000. kBytes
   nonl-proj :       2569. kBytes
   fftplans  :         89. kBytes
   grid      :        270. kBytes
   one-center:          6. kBytes
   wavefun   :        698. kBytes
 
     INWAV:  cpu time    0.0000: real time    0.0006
 Broyden mixing: mesh for mixing (old mesh)
   NGX =  9   NGY =  9   NGZ =  9
  (NGX  = 32   NGY  = 32   NGZ  = 32)
  gives a total of    729 points

 initial charge density was supplied:
 charge density of overlapping atoms calculated
 number of electron       8.0000000 magnetization 
 keeping initial charge density in first step


--------------------------------------------------------------------------------------------------------


 Maximum index for augmentation-charges          295 (set IRDMAX)


--------------------------------------------------------------------------------------------------------


 First call to EWALD:  gamma=   0.798
 Maximum number of real-space cells 3x 3x 3
 Maximum number of reciprocal cells 3x 3x 3

 FEWALD executed in parallel
    FEWALD:  cpu time    0.0020: real time    0.0022


----------------------------------------- Iteration    1(   1)  ---------------------------------------


    POTLOK:  cpu time    0.0010: real time    0.0010
    SETDIJ:  cpu time    0.0000: real time    0.0004
     EDDAV:  cpu time    0.4589: real time    0.4601
       DOS:  cpu time    0.0010: real time    0.0010
    --------------------------------------------
      LOOP:  cpu time    0.4649: real time    0.4671

 eigenvalue-minimisations  :  8640
 total energy-change (2. order) :-0.1946898E+02  (-0.4397831E+03)
 number of electron       8.0000000 magnetization 
 augmentation part        8.0000000 magnetization 

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        27.93469176
  Ewald energy   TEWEN  =      -351.95391401
  -Hartree energ DENC   =       -16.70509320
  -exchange      EXHF   =         0.00000000
  -V(xc)+E(xc)   XCENC  =        27.57096615
  PAW double counting   =       216.12168763     -217.13432942
  entropy T*S    EENTRO =        -0.00000000
  eigenvalues    EBANDS =         1.38280852
  atomic energy  EATOM  =       293.31420618
  Solvation  Ediel_sol  =         0.00000000
  ---------------------------------------------------
  free energy    TOTEN  =       -19.46897639 eV

  energy without entropy =      -19.46897639  energy(sigma->0) =      -19.46897639


--------------------------------------------------------------------------------------------------------




----------------------------------------- Iteration    1(   2)  ---------------------------------------


     EDDAV:  cpu time    0.5869: real time    0.5867
       DOS:  cpu time    0.0010: real time    0.0008
    --------------------------------------------
      LOOP:  cpu time    0.5879: real time    0.5925

 eigenvalue-minimisations  : 10260
 total energy-change (2. order) :-0.1657008E+01  (-0.1657008E+01)
 number of electron       8.0000000 magnetization 
 augmentation part        8.0000000 magnetization 

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        27.93469176
  Ewald energy   TEWEN  =      -351.95391401
  -Hartree energ DENC   =       -16.70509320
  -exchange      EXHF   =         0.00000000
  -V(xc)+E(xc)   XCENC  =        27.57096615
  PAW double counting   =       216.12168763     -217.13432942
  entropy T*S    EENTRO =        -0.00000000
  eigenvalues    EBANDS =        -0.27419949
  atomic energy  EATOM  =       293.31420618
  Solvation  Ediel_sol  =         0.00000000
  ---------------------------------------------------
  free energy    TOTEN  =       -21.12598440 eV

  energy without entropy =      -21.12598440  energy(sigma->0) =      -21.12598440


--------------------------------------------------------------------------------------------------------




----------------------------------------- Iteration    1(   3)  ---------------------------------------


     EDDAV:  cpu time    0.5229: real time    0.5234
       DOS:  cpu time    0.0010: real time    0.0009
    --------------------------------------------
      LOOP:  cpu time    0.5239: real time    0.5294

 eigenvalue-minimisations  :  9000
 total energy-change (2. order) :-0.9384440E-03  (-0.9384440E-03)
 number of electron       8.0000000 magnetization 
 augmentation part        8.0000000 magnetization 

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        27.93469176
  Ewald energy   TEWEN  =      -351.95391401
  -Hartree energ DENC   =       -16.70509320
  -exchange      EXHF   =         0.00000000
  -V(xc)+E(xc)   XCENC  =        27.57096615
  PAW double counting   =       216.12168763     -217.13432942
  entropy T*S    EENTRO =        -0.00000000
  eigenvalues    EBANDS =        -0.27513794
  atomic energy  EATOM  =       293.31420618
  Solvation  Ediel_sol  =         0.00000000
  ---------------------------------------------------
  free energy    TOTEN  =       -21.12692285 eV

  energy without entropy =      -21.12692285  energy(sigma->0) =      -21.12692285


--------------------------------------------------------------------------------------------------------




----------------------------------------- Iteration    1(   4)  ---------------------------------------


     EDDAV:  cpu time    0.7549: real time    0.7559
       DOS:  cpu time    0.0000: real time    0.0008
    --------------------------------------------
      LOOP:  cpu time    0.7569: real time    0.7614

 eigenvalue-minimisations  : 11520
 total energy-change (2. order) :-0.8105468E-07  (-0.8105461E-07)
 number of electron       8.0000000 magnetization 
 augmentation part        8.0000000 magnetization 

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        27.93469176
  Ewald energy   TEWEN  =      -351.95391401
  -Hartree energ DENC   =       -16.70509320
  -exchange      EXHF   =         0.00000000
  -V(xc)+E(xc)   XCENC  =        27.57096615
  PAW double counting   =       216.12168763     -217.13432942
  entropy T*S    EENTRO =        -0.00000000
  eigenvalues    EBANDS =        -0.27513802
  atomic energy  EATOM  =       293.31420618
  Solvation  Ediel_sol  =         0.00000000
  ---------------------------------------------------
  free energy    TOTEN  =       -21.12692293 eV

  energy without entropy =      -21.12692293  energy(sigma->0) =      -21.12692293


--------------------------------------------------------------------------------------------------------




----------------------------------------- Iteration    1(   5)  ---------------------------------------


     EDDAV:  cpu time    0.4999: real time    0.5001
       DOS:  cpu time    0.0010: real time    0.0008
    CHARGE:  cpu time    0.0090: real time    0.0091
    MIXING:  cpu time    0.0010: real time    0.0008
    --------------------------------------------
      LOOP:  cpu time    0.5119: real time    0.5168

 eigenvalue-minimisations  :  8800
 total energy-change (2. order) :-0.1705303E-12  (-0.5226545E-13)
 number of electron       7.9999998 magnetization 
 augmentation part        0.2375544 magnetization 

 Broyden mixing:
  rms(total) = 0.60029E+00    rms(broyden)= 0.60025E+00
  rms(prec ) = 0.20135E+01
  weight for this iteration     100.00

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        27.93469176
  Ewald energy   TEWEN  =      -351.95391401
  -Hartree energ DENC   =       -16.70509320
  -exchange      EXHF   =         0.00000000
  -V(xc)+E(xc)   XCENC  =        27.57096615
  PAW double counting   =       216.12168763     -217.13432942
  entropy T*S    EENTRO =        -0.00000000
  eigenvalues    EBANDS =        -0.27513802
  atomic energy  EATOM  =       293.31420618
  Solvation  Ediel_sol  =         0.00000000
  ---------------------------------------------------
  free energy    TOTEN  =       -21.12692293 eV

  energy without entropy =      -21.12692293  energy(sigma->0) =      -21.12692293


--------------------------------------------------------------------------------------------------------




----------------------------------------- Iteration    1(   6)  ---------------------------------------


    POTLOK:  cpu time    0.0010: real time    0.0007
    SETDIJ:  cpu time    0.0000: real time    0.0002
    EDDIAG:  cpu time    0.1380: real time    0.1378
  RMM-DIIS:  cpu time    0.0450: real time    0.0452
    ORTHCH:  cpu time    0.0230: real time    0.0232
       DOS:  cpu time    0.0010: real time    0.0010
    CHARGE:  cpu time    0.0090: real time    0.0091
    MIXING:  cpu time    0.0000: real time    0.0006
    --------------------------------------------
      LOOP:  cpu time    0.2180: real time    0.2239

 eigenvalue-minimisations  :  7280
 total energy-change (2. order) : 0.6429457E+00  (-0.8144107E-02)
 number of electron       7.9999998 magnetization 
 augmentation part        0.2319879 magnetization 

 Broyden mixing:
  rms(total) = 0.35424E+00    rms(broyden)= 0.35424E+00
  rms(prec ) = 0.10698E+01
  weight for this iteration     100.00

 eigenvalues of (default mixing * dielectric matrix)
  average eigenvalue GAMMA=   2.2855
  2.2855

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        27.93469176
  Ewald energy   TEWEN  =      -351.95391401
  -Hartree energ DENC   =       -20.75550967
  -exchange      EXHF   =         0.00000000
  -V(xc)+E(xc)   XCENC  =        27.96962555
  PAW double counting   =       398.77302830     -399.93831995
  entropy T*S    EENTRO =        -0.00000000
  eigenvalues    EBANDS =         4.17221466
  atomic energy  EATOM  =       293.31420618
  Solvation  Ediel_sol  =         0.00000000
  ---------------------------------------------------
  free energy    TOTEN  =       -20.48397718 eV

  energy without entropy =      -20.48397718  energy(sigma->0) =      -20.48397718


--------------------------------------------------------------------------------------------------------




----------------------------------------- Iteration    1(   7)  ---------------------------------------


    POTLOK:  cpu time    0.0010: real time    0.0007
    SETDIJ:  cpu time    0.0000: real time    0.0002
    EDDIAG:  cpu time    0.1350: real time    0.1353
  RMM-DIIS:  cpu time    0.0500: real time    0.0499
    ORTHCH:  cpu time    0.0230: real time    0.0231
       DOS:  cpu time    0.0010: real time    0.0011
    CHARGE:  cpu time    0.0090: real time    0.0090
    MIXING:  cpu time    0.0010: real time    0.0005
    --------------------------------------------
      LOOP:  cpu time    0.2200: real time    0.2258

 eigenvalue-minimisations  :  7280
 total energy-change (2. order) : 0.2253543E+00  (-0.9542215E-02)
 number of electron       7.9999998 magnetization 
 augmentation part        0.2257639 magnetization 

 Broyden mixing:
  rms(total) = 0.80621E-01    rms(broyden)= 0.80613E-01
  rms(prec ) = 0.11670E+00
  weight for this iteration     100.00

 eigenvalues of (default mixing * dielectric matrix)
  average eigenvalue GAMMA=   2.2084
  2.0854  2.3314

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        27.93469176
  Ewald energy   TEWEN  =      -351.95391401
  -Hartree energ DENC   =       -25.72900449
  -exchange      EXHF   =         0.00000000
  -V(xc)+E(xc)   XCENC  =        28.48309268
  PAW double counting   =       736.16399968     -737.46826826
  entropy T*S    EENTRO =        -0.00000000
  eigenvalues    EBANDS =         8.99657358
  atomic energy  EATOM  =       293.31420618
  Solvation  Ediel_sol  =         0.00000000
  ---------------------------------------------------
  free energy    TOTEN  =       -20.25862289 eV

  energy without entropy =      -20.25862289  energy(sigma->0) =      -20.25862289


--------------------------------------------------------------------------------------------------------




----------------------------------------- Iteration    1(   8)  ---------------------------------------


    POTLOK:  cpu time    0.0010: real time    0.0007
    SETDIJ:  cpu time    0.0000: real time    0.0002
    EDDIAG:  cpu time    0.1350: real time    0.1351
  RMM-DIIS:  cpu time    0.0500: real time    0.0499
    ORTHCH:  cpu time    0.0230: real time    0.0232
       DOS:  cpu time    0.0010: real time    0.0011
    CHARGE:  cpu time    0.0090: real time    0.0090
    MIXING:  cpu time    0.0000: real time    0.0004
    --------------------------------------------
      LOOP:  cpu time    0.2200: real time    0.2256

 eigenvalue-minimisations  :  7280
 total energy-change (2. order) : 0.8889107E-03  (-0.3157123E-04)
 number of electron       7.9999998 magnetization 
 augmentation part        0.2256719 magnetization 

 Broyden mixing:
  rms(total) = 0.35841E-02    rms(broyden)= 0.35795E-02
  rms(prec ) = 0.88585E-02
  weight for this iteration     100.00

 eigenvalues of (default mixing * dielectric matrix)
  average eigenvalue GAMMA=   1.5732
  2.3358  2.0732  0.3105

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        27.93469176
  Ewald energy   TEWEN  =      -351.95391401
  -Hartree energ DENC   =       -25.67895389
  -exchange      EXHF   =         0.00000000
  -V(xc)+E(xc)   XCENC  =        28.48462481
  PAW double counting   =       831.81915802     -833.08424045
  entropy T*S    EENTRO =        -0.00000000
  eigenvalues    EBANDS =         8.90669360
  atomic energy  EATOM  =       293.31420618
  Solvation  Ediel_sol  =         0.00000000
  ---------------------------------------------------
  free energy    TOTEN  =       -20.25773398 eV

  energy without entropy =      -20.25773398  energy(sigma->0) =      -20.25773398


--------------------------------------------------------------------------------------------------------




----------------------------------------- Iteration    1(   9)  ---------------------------------------


    POTLOK:  cpu time    0.0010: real time    0.0008
    SETDIJ:  cpu time    0.0000: real time    0.0002
    EDDIAG:  cpu time    0.1350: real time    0.1347
  RMM-DIIS:  cpu time    0.0500: real time    0.0498
    ORTHCH:  cpu time    0.0230: real time    0.0231
       DOS:  cpu time    0.0010: real time    0.0010
    CHARGE:  cpu time    0.0090: real time    0.0090
    MIXING:  cpu time    0.0000: real time    0.0005
    --------------------------------------------
      LOOP:  cpu time    0.2200: real time    0.2250

 eigenvalue-minimisations  :  7280
 total energy-change (2. order) :-0.5434026E-07  (-0.2400028E-06)
 number of electron       7.9999998 magnetization 
 augmentation part        0.2256597 magnetization 

 Broyden mixing:
  rms(total) = 0.31951E-02    rms(broyden)= 0.31949E-02
  rms(prec ) = 0.43573E-02
  weight for this iteration     100.00

 eigenvalues of (default mixing * dielectric matrix)
  average eigenvalue GAMMA=   2.0458
  0.9722  2.7120  2.4494  2.0497

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        27.93469176
  Ewald energy   TEWEN  =      -351.95391401
  -Hartree energ DENC   =       -25.70408383
  -exchange      EXHF   =         0.00000000
  -V(xc)+E(xc)   XCENC  =        28.48759030
  PAW double counting   =       833.98682027     -835.25131321
  entropy T*S    EENTRO =        -0.00000000
  eigenvalues    EBANDS =         8.92826851
  atomic energy  EATOM  =       293.31420618
  Solvation  Ediel_sol  =         0.00000000
  ---------------------------------------------------
  free energy    TOTEN  =       -20.25773404 eV

  energy without entropy =      -20.25773404  energy(sigma->0) =      -20.25773404


--------------------------------------------------------------------------------------------------------




----------------------------------------- Iteration    1(  10)  ---------------------------------------


    POTLOK:  cpu time    0.0010: real time    0.0008
    SETDIJ:  cpu time    0.0000: real time    0.0002
    EDDIAG:  cpu time    0.1350: real time    0.1349
  RMM-DIIS:  cpu time    0.0500: real time    0.0499
    ORTHCH:  cpu time    0.0230: real time    0.0231
       DOS:  cpu time    0.0010: real time    0.0010
    CHARGE:  cpu time    0.0090: real time    0.0090
    MIXING:  cpu time    0.0010: real time    0.0005
    --------------------------------------------
      LOOP:  cpu time    0.2210: real time    0.2254

 eigenvalue-minimisations  :  7280
 total energy-change (2. order) :-0.1819138E-05  (-0.5235489E-07)
 number of electron       7.9999998 magnetization 
 augmentation part        0.2256590 magnetization 

 Broyden mixing:
  rms(total) = 0.24365E-03    rms(broyden)= 0.24357E-03
  rms(prec ) = 0.36997E-03
  weight for this iteration     100.00

 eigenvalues of (default mixing * dielectric matrix)
  average eigenvalue GAMMA=   1.8740
  2.6259  2.4212  2.0011  1.0009  1.3208

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        27.93469176
  Ewald energy   TEWEN  =      -351.95391401
  -Hartree energ DENC   =       -25.71129067
  -exchange      EXHF   =         0.00000000
  -V(xc)+E(xc)   XCENC  =        28.48854901
  PAW double counting   =       830.61665265     -831.88076797
  entropy T*S    EENTRO =        -0.00000000
  eigenvalues    EBANDS =         8.93413719
  atomic energy  EATOM  =       293.31420618
  Solvation  Ediel_sol  =         0.00000000
  ---------------------------------------------------
  free energy    TOTEN  =       -20.25773586 eV

  energy without entropy =      -20.25773586  energy(sigma->0) =      -20.25773586


--------------------------------------------------------------------------------------------------------




----------------------------------------- Iteration    1(  11)  ---------------------------------------


    POTLOK:  cpu time    0.0010: real time    0.0008
    SETDIJ:  cpu time    0.0000: real time    0.0003
    EDDIAG:  cpu time    0.1340: real time    0.1345
  RMM-DIIS:  cpu time    0.0600: real time    0.0598
    ORTHCH:  cpu time    0.0230: real time    0.0232
       DOS:  cpu time    0.0020: real time    0.0011
    CHARGE:  cpu time    0.0080: real time    0.0089
    MIXING:  cpu time    0.0000: real time    0.0005
    --------------------------------------------
      LOOP:  cpu time    0.2300: real time    0.2352

 eigenvalue-minimisations  :  7203
 total energy-change (2. order) : 0.1167734E-07  (-0.2281749E-08)
 number of electron       7.9999998 magnetization 
 augmentation part        0.2256612 magnetization 

 Broyden mixing:
  rms(total) = 0.53067E-04    rms(broyden)= 0.53061E-04
  rms(prec ) = 0.10944E-03
  weight for this iteration     100.00

 eigenvalues of (default mixing * dielectric matrix)
  average eigenvalue GAMMA=   1.9411
  2.6031  2.5989  2.4498  2.0250  0.9950  0.9748

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        27.93469176
  Ewald energy   TEWEN  =      -351.95391401
  -Hartree energ DENC   =       -25.70984822
  -exchange      EXHF   =         0.00000000
  -V(xc)+E(xc)   XCENC  =        28.48841567
  PAW double counting   =       830.88123748     -832.14520958
  entropy T*S    EENTRO =        -0.00000000
  eigenvalues    EBANDS =         8.93268487
  atomic energy  EATOM  =       293.31420618
  Solvation  Ediel_sol  =         0.00000000
  ---------------------------------------------------
  free energy    TOTEN  =       -20.25773585 eV

  energy without entropy =      -20.25773585  energy(sigma->0) =      -20.25773585


--------------------------------------------------------------------------------------------------------




----------------------------------------- Iteration    1(  12)  ---------------------------------------


    POTLOK:  cpu time    0.0010: real time    0.0007
    SETDIJ:  cpu time    0.0000: real time    0.0002
    EDDIAG:  cpu time    0.1350: real time    0.1347
  RMM-DIIS:  cpu time    0.0630: real time    0.0632
    ORTHCH:  cpu time    0.0230: real time    0.0231
       DOS:  cpu time    0.0010: real time    0.0010
    --------------------------------------------
      LOOP:  cpu time    0.2240: real time    0.2292

 eigenvalue-minimisations  :  4932
 total energy-change (2. order) : 0.1842295E-08  (-0.1262391E-09)
 number of electron       7.9999998 magnetization 
 augmentation part        0.2256612 magnetization 

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        27.93469176
  Ewald energy   TEWEN  =      -351.95391401
  -Hartree energ DENC   =       -25.71024258
  -exchange      EXHF   =         0.00000000
  -V(xc)+E(xc)   XCENC  =        28.48845088
  PAW double counting   =       830.82166426     -832.08568241
  entropy T*S    EENTRO =        -0.00000000
  eigenvalues    EBANDS =         8.93309007
  atomic energy  EATOM  =       293.31420618
  Solvation  Ediel_sol  =         0.00000000
  ---------------------------------------------------
  free energy    TOTEN  =       -20.25773584 eV

  energy without entropy =      -20.25773584  energy(sigma->0) =      -20.25773584


--------------------------------------------------------------------------------------------------------




 average (electrostatic) potential at core
  the test charge radii are     0.6991
  (the norm of the test charge is              1.0000)
       1 -49.0266       2 -49.0266
 
 
 
 E-fermi :  10.4786     XC(G=0): -13.6661     alpha+bet :-18.5975


 k-point     1 :       0.0417    0.0417    0.0417
  band No.  band energies     occupation 
      1     -11.5029      2.00000
      2       9.8942      2.00000
      3      10.1542      2.00000
      4      10.1542      2.00000
      5      16.0024      0.00000
      6      16.0024      0.00000
      7      16.1116      0.00000
      8      24.5980      0.00000
      9      29.7750      0.00000
     10      36.1219      0.00000
     11      36.1219      0.00000
     12      37.7405      0.00000
     13      39.2752      0.00000
     14      39.2752      0.00000
     15      45.6433      0.00000
     16      58.3874      0.00000
     17      58.4863      0.00000
     18      58.4863      0.00000
     19      78.6621      0.00000
     20      78.6622      0.00000

 k-point     2 :       0.1250    0.0417    0.0417
  band No.  band energies     occupation 
      1     -11.2410      2.00000
      2       8.5800      2.00000
      3       9.2849      2.00000
      4      10.0015      2.00000
      5      16.2586      0.00000
      6      16.7672      0.00000
      7      17.0674      0.00000
      8      24.7203      0.00000
      9      30.1822      0.00000
     10      33.6688      0.00000
     11      34.9034      0.00000
     12      37.8977      0.00000
     13      40.5183      0.00000
     14      42.8415      0.00000
     15      47.6279      0.00000
     16      57.4664      0.00000
     17      57.6600      0.00000
     18      58.1168      0.00000
     19      75.6701      0.00000
     20      76.2226      0.00000

 k-point     3 :       0.2083    0.0417    0.0417
  band No.  band energies     occupation 
      1     -10.5891      2.00000
      2       5.9467      2.00000
      3       8.4811      2.00000
      4       9.3491      2.00000
      5      17.1169      0.00000
      6      17.8274      0.00000
      7      18.1806      0.00000
      8      24.9648      0.00000
      9      30.8301      0.00000
     10      32.2104      0.00000
     11      33.7266      0.00000
     12      36.8466      0.00000
     13      44.6302      0.00000
     14      47.0745      0.00000
     15      51.3820      0.00000
     16      55.4691      0.00000
     17      55.9020      0.00000
     18      56.5991      0.00000
     19      72.1384      0.00000
     20      72.6407      0.00000

 k-point     4 :       0.2917    0.0417    0.0417
  band No.  band energies     occupation 
      1      -9.5558      2.00000
      2       3.0716      2.00000
      3       7.7980      2.00000
      4       8.5889      2.00000
      5      17.9828      0.00000
      6      18.6213      0.00000
      7      18.9816      0.00000
      8      25.3106      0.00000
      9      31.2150      0.00000
     10      32.0030      0.00000
     11      33.7282      0.00000
     12      36.4154      0.00000
     13      49.3840      0.00000
     14      51.7978      0.00000
     15      52.3679      0.00000
     16      53.9257      0.00000
     17      54.6771      0.00000
     18      56.3084      0.00000
     19      70.2450      0.00000
     20      70.3732      0.00000

 k-point     5 :       0.3750    0.0417    0.0417
  band No.  band energies     occupation 
      1      -8.1626      2.00000
      2       0.2746      2.00000
      3       7.3362      2.00000
      4       7.9363      2.00000
      5      18.5247      0.00000
      6      18.8977      0.00000
      7      19.5003      0.00000
      8      25.6867      0.00000
      9      31.4676      0.00000
     10      33.0960      0.00000
     11      34.6888      0.00000
     12      36.2067      0.00000
     13      48.7126      0.00000
     14      50.2246      0.00000
     15      54.1971      0.00000
     16      55.5384      0.00000
     17      57.1791      0.00000
     18      61.7255      0.00000
     19      69.4488      0.00000
     20      69.6075      0.00000

 k-point     6 :       0.4583    0.0417    0.0417
  band No.  band energies     occupation 
      1      -6.4907      2.00000
      2      -2.2341      2.00000
      3       7.1328      2.00000
      4       7.4809      2.00000
      5      18.7835      0.00000
      6      18.8444      0.00000
      7      19.7814      0.00000
      8      25.9478      0.00000
      9      31.9044      0.00000
     10      35.0482      0.00000
     11      35.1245      0.00000
     12      36.5967      0.00000
     13      45.7577      0.00000
     14      46.7788      0.00000
     15      56.1399      0.00000
     16      60.5391      0.00000
     17      62.5596      0.00000
     18      66.8176      0.00000
     19      68.9578      0.00000
     20      69.5019      0.00000

 k-point     7 :      -0.4583    0.0417    0.0417
  band No.  band energies     occupation 
      1      -5.5386      2.00000
      2      -3.3992      2.00000
      3       7.1871      2.00000
      4       7.2591      2.00000
      5      18.6950      0.00000
      6      18.9422      0.00000
      7      19.8521      0.00000
      8      25.9922      0.00000
      9      32.1078      0.00000
     10      34.8910      0.00000
     11      36.4548      0.00000
     12      36.5582      0.00000
     13      44.9035      0.00000
     14      45.4330      0.00000
     15      56.8246      0.00000
     16      63.9167      0.00000
     17      64.6144      0.00000
     18      67.5898      0.00000
     19      68.6861      0.00000
     20      68.9529      0.00000

 k-point     8 :      -0.3750    0.0417    0.0417
  band No.  band energies     occupation 
      1      -7.0652      2.00000
      2      -1.4487      2.00000
      3       7.2915      2.00000
      4       7.4887      2.00000
      5      18.5259      0.00000
      6      19.0701      0.00000
      7      19.7290      0.00000
      8      25.8397      0.00000
      9      31.7308      0.00000
     10      34.3305      0.00000
     11      35.6885      0.00000
     12      35.9276      0.00000
     13      46.3957      0.00000
     14      47.9941      0.00000
     15      55.6912      0.00000
     16      58.6931      0.00000
     17      60.6567      0.00000
     18      65.4458      0.00000
     19      69.2901      0.00000
     20      69.5005      0.00000

 k-point     9 :      -0.2917    0.0417    0.0417
  band No.  band energies     occupation 
      1      -8.6644      2.00000
      2       1.1849      2.00000
      3       7.5849      2.00000
      4       8.0132      2.00000
      5      18.2063      0.00000
      6      19.0042      0.00000
      7      19.3964      0.00000
      8      25.5005      0.00000
      9      31.3690      0.00000
     10      32.6688      0.00000
     11      34.4884      0.00000
     12      36.1029      0.00000
     13      49.8381      0.00000
     14      51.4864      0.00000
     15      53.2115      0.00000
     16      54.2402      0.00000
     17      55.5085      0.00000
     18      59.9505      0.00000
     19      69.6782      0.00000
     20      69.7434      0.00000

 k-point    10 :      -0.2083    0.0417    0.0417
  band No.  band energies     occupation 
      1      -9.9416      2.00000
      2       4.0311      2.00000
      3       8.1291      2.00000
      4       8.7117      2.00000
      5      17.5598      0.00000
      6      18.5431      0.00000
      7      18.7993      0.00000
      8      25.1224      0.00000
      9      31.1326      0.00000
     10      31.8851      0.00000
     11      33.8675      0.00000
     12      36.3232      0.00000
     13      48.0566      0.00000
     14      49.7487      0.00000
     15      53.5676      0.00000
     16      54.2850      0.00000
     17      54.9955      0.00000
     18      55.2328      0.00000
     19      70.6502      0.00000
     20      71.0654      0.00000

 k-point    11 :      -0.1250    0.0417    0.0417
  band No.  band energies     occupation 
      1     -10.8493      2.00000
      2       6.8768      2.00000
      3       8.8685      2.00000
      4       9.4674      2.00000
      5      16.6330      0.00000
      6      17.6392      0.00000
      7      17.8586      0.00000
      8      24.8318      0.00000
      9      30.6301      0.00000
     10      32.3207      0.00000
     11      34.5229      0.00000
     12      36.8837      0.00000
     13      43.4787      0.00000
     14      45.1575      0.00000
     15      50.1365      0.00000
     16      56.2786      0.00000
     17      56.4139      0.00000
     18      57.2647      0.00000
     19      73.1370      0.00000
     20      73.8461      0.00000

 k-point    12 :      -0.0417    0.0417    0.0417
  band No.  band energies     occupation 
      1     -11.3719      2.00000
      2       9.2895      2.00000
      3       9.6559      2.00000
      4      10.0019      2.00000
      5      15.9138      0.00000
      6      16.6140      0.00000
      7      16.6784      0.00000
      8      24.6465      0.00000
      9      29.9938      0.00000
     10      33.9449      0.00000
     11      36.3572      0.00000
     12      37.9075      0.00000
     13      39.5183      0.00000
     14      41.3059      0.00000
     15      46.7839      0.00000
     16      57.9597      0.00000
     17      58.0303      0.00000
     18      58.3431      0.00000
     19      77.2784      0.00000
     20      77.5621      0.00000

 k-point    13 :       0.1250    0.1250    0.0417
  band No.  band energies     occupation 
      1     -11.1102      2.00000
      2       8.4778      2.00000
      3       8.8815      2.00000
      4       9.5056      2.00000
      5      15.7357      0.00000
      6      17.6083      0.00000
      7      17.6327      0.00000
      8      24.5582      0.00000
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 k-point    14 :       0.2083    0.1250    0.0417
  band No.  band energies     occupation 
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 k-point    15 :       0.2917    0.1250    0.0417
  band No.  band energies     occupation 
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 k-point    16 :       0.3750    0.1250    0.0417
  band No.  band energies     occupation 
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 k-point    17 :       0.4583    0.1250    0.0417
  band No.  band energies     occupation 
      1      -6.8190      2.00000
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 k-point    18 :      -0.4583    0.1250    0.0417
  band No.  band energies     occupation 
      1      -5.3083      2.00000
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 k-point    19 :      -0.3750    0.1250    0.0417
  band No.  band energies     occupation 
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 k-point    20 :      -0.2917    0.1250    0.0417
  band No.  band energies     occupation 
      1      -7.9113      2.00000
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 k-point    21 :      -0.2083    0.1250    0.0417
  band No.  band energies     occupation 
      1      -9.2991      2.00000
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 k-point    22 :      -0.1250    0.1250    0.0417
  band No.  band energies     occupation 
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 k-point    23 :      -0.0417    0.1250    0.0417
  band No.  band energies     occupation 
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 k-point    24 :       0.2083    0.2083    0.0417
  band No.  band energies     occupation 
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 k-point    25 :       0.2917    0.2083    0.0417
  band No.  band energies     occupation 
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 k-point    26 :       0.3750    0.2083    0.0417
  band No.  band energies     occupation 
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 k-point    27 :       0.4583    0.2083    0.0417
  band No.  band energies     occupation 
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 k-point    28 :      -0.4583    0.2083    0.0417
  band No.  band energies     occupation 
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 k-point    29 :      -0.3750    0.2083    0.0417
  band No.  band energies     occupation 
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 k-point    30 :      -0.2917    0.2083    0.0417
  band No.  band energies     occupation 
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 k-point    31 :      -0.2083    0.2083    0.0417
  band No.  band energies     occupation 
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 k-point    32 :      -0.1250    0.2083    0.0417
  band No.  band energies     occupation 
      1      -9.4269      2.00000
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 k-point    33 :      -0.0417    0.2083    0.0417
  band No.  band energies     occupation 
      1     -10.1999      2.00000
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 k-point    34 :       0.2917    0.2917    0.0417
  band No.  band energies     occupation 
      1      -8.7837      2.00000
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 k-point    35 :       0.3750    0.2917    0.0417
  band No.  band energies     occupation 
      1      -7.7704      2.00000
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 k-point    36 :       0.4583    0.2917    0.0417
  band No.  band energies     occupation 
      1      -6.4125      2.00000
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 k-point    37 :      -0.4583    0.2917    0.0417
  band No.  band energies     occupation 
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 k-point    38 :      -0.3750    0.2917    0.0417
  band No.  band energies     occupation 
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 k-point    39 :      -0.2917    0.2917    0.0417
  band No.  band energies     occupation 
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 k-point    40 :      -0.2083    0.2917    0.0417
  band No.  band energies     occupation 
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 k-point    41 :      -0.1250    0.2917    0.0417
  band No.  band energies     occupation 
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 k-point    42 :      -0.0417    0.2917    0.0417
  band No.  band energies     occupation 
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 k-point    43 :       0.3750    0.3750    0.0417
  band No.  band energies     occupation 
      1      -6.8913      2.00000
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 k-point    44 :       0.4583    0.3750    0.0417
  band No.  band energies     occupation 
      1      -5.6648      2.00000
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 k-point    45 :      -0.4583    0.3750    0.0417
  band No.  band energies     occupation 
      1      -4.1559      2.00000
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 k-point    46 :      -0.3750    0.3750    0.0417
  band No.  band energies     occupation 
      1      -2.8793      2.00000
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 k-point    47 :      -0.2917    0.3750    0.0417
  band No.  band energies     occupation 
      1      -3.8589      2.00000
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 k-point    48 :      -0.2083    0.3750    0.0417
  band No.  band energies     occupation 
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 k-point    49 :      -0.1250    0.3750    0.0417
  band No.  band energies     occupation 
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 k-point    50 :      -0.0417    0.3750    0.0417
  band No.  band energies     occupation 
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 k-point    51 :       0.4583    0.4583    0.0417
  band No.  band energies     occupation 
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 k-point    52 :      -0.4583    0.4583    0.0417
  band No.  band energies     occupation 
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 k-point    53 :      -0.3750    0.4583    0.0417
  band No.  band energies     occupation 
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 k-point    54 :      -0.2917    0.4583    0.0417
  band No.  band energies     occupation 
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 k-point    55 :      -0.2083    0.4583    0.0417
  band No.  band energies     occupation 
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 k-point    56 :      -0.1250    0.4583    0.0417
  band No.  band energies     occupation 
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 k-point    57 :      -0.0417    0.4583    0.0417
  band No.  band energies     occupation 
      1      -5.8630      2.00000
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 k-point    58 :      -0.4583   -0.4583    0.0417
  band No.  band energies     occupation 
      1      -3.2781      2.00000
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 k-point    59 :      -0.3750   -0.4583    0.0417
  band No.  band energies     occupation 
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 k-point    60 :      -0.2917   -0.4583    0.0417
  band No.  band energies     occupation 
      1      -5.3254      2.00000
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 k-point    61 :      -0.2083   -0.4583    0.0417
  band No.  band energies     occupation 
      1      -5.8393      2.00000
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 k-point    62 :      -0.1250   -0.4583    0.0417
  band No.  band energies     occupation 
      1      -6.0067      2.00000
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 k-point    63 :      -0.3750   -0.3750    0.0417
  band No.  band energies     occupation 
      1      -5.7807      2.00000
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 k-point    64 :      -0.2917   -0.3750    0.0417
  band No.  band energies     occupation 
      1      -6.7704      2.00000
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 k-point    65 :      -0.2083   -0.3750    0.0417
  band No.  band energies     occupation 
      1      -7.4008      2.00000
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 k-point    66 :      -0.1250   -0.3750    0.0417
  band No.  band energies     occupation 
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 k-point    67 :      -0.2917   -0.2917    0.0417
  band No.  band energies     occupation 
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 k-point    68 :      -0.2083   -0.2917    0.0417
  band No.  band energies     occupation 
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 k-point    69 :      -0.1250   -0.2917    0.0417
  band No.  band energies     occupation 
      1      -9.0424      2.00000
      2       3.3094      2.00000
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 k-point    70 :      -0.2083   -0.2083    0.0417
  band No.  band energies     occupation 
      1      -9.5531      2.00000
      2       5.8053      2.00000
      3       6.3569      2.00000
      4       6.7650      2.00000
      5      14.9911      0.00000
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     10      32.2389      0.00000
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 k-point    71 :      -0.1250   -0.2083    0.0417
  band No.  band energies     occupation 
      1     -10.0699      2.00000
      2       5.9286      2.00000
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     10      31.5711      0.00000
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 k-point    72 :      -0.1250   -0.1250    0.0417
  band No.  band energies     occupation 
      1     -10.7188      2.00000
      2       7.5897      2.00000
      3       8.0157      2.00000
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      5      15.4955      0.00000
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     10      30.9455      0.00000
     11      37.4742      0.00000
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     19      71.9321      0.00000
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 k-point    73 :       0.1250    0.1250    0.1250
  band No.  band energies     occupation 
      1     -11.1103      2.00000
      2       7.7840      2.00000
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      5      16.7768      0.00000
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     10      33.9563      0.00000
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     19      74.8429      0.00000
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 k-point    74 :       0.2083    0.1250    0.1250
  band No.  band energies     occupation 
      1     -10.7191      2.00000
      2       6.8519      2.00000
      3       7.8815      2.00000
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     10      31.8631      0.00000
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     19      72.4092      0.00000
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 k-point    75 :       0.2917    0.1250    0.1250
  band No.  band energies     occupation 
      1      -9.9415      2.00000
      2       5.0706      2.00000
      3       6.3200      2.00000
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     10      31.3187      0.00000
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     18      56.3250      0.00000
     19      70.1665      0.00000
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 k-point    76 :       0.3750    0.1250    0.1250
  band No.  band energies     occupation 
      1      -8.7898      2.00000
      2       2.3432      2.00000
      3       5.7629      2.00000
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      5      18.4774      0.00000
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     10      31.4028      0.00000
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     18      59.8083      0.00000
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 k-point    77 :       0.4583    0.1250    0.1250
  band No.  band energies     occupation 
      1      -7.2967      2.00000
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 k-point    78 :      -0.4583    0.1250    0.1250
  band No.  band energies     occupation 
      1      -5.6290      2.00000
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 k-point    79 :      -0.3750    0.1250    0.1250
  band No.  band energies     occupation 
      1      -5.6258      2.00000
      2      -2.6142      2.00000
      3       6.0081      2.00000
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     10      34.6813      0.00000
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 k-point    80 :      -0.2917    0.1250    0.1250
  band No.  band energies     occupation 
      1      -7.2945      2.00000
      2      -0.3404      2.00000
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     10      33.3232      0.00000
     11      37.2304      0.00000
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 k-point    81 :      -0.2083    0.1250    0.1250
  band No.  band energies     occupation 
      1      -8.7887      2.00000
      2       2.3171      2.00000
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 k-point    82 :      -0.1250    0.1250    0.1250
  band No.  band energies     occupation 
      1      -9.9409      2.00000
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 k-point    83 :       0.2083    0.2083    0.1250
  band No.  band energies     occupation 
      1     -10.4590      2.00000
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 k-point    84 :       0.2917    0.2083    0.1250
  band No.  band energies     occupation 
      1      -9.8121      2.00000
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 k-point    85 :       0.3750    0.2083    0.1250
  band No.  band energies     occupation 
      1      -8.7883      2.00000
      2       3.4101      2.00000
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 k-point    86 :       0.4583    0.2083    0.1250
  band No.  band energies     occupation 
      1      -7.4121      2.00000
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      5      18.4842      0.00000
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 k-point    87 :      -0.4583    0.2083    0.1250
  band No.  band energies     occupation 
      1      -5.7716      2.00000
      2      -1.5599      2.00000
      3       4.4358      2.00000
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      5      18.5420      0.00000
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 k-point    88 :      -0.3750    0.2083    0.1250
  band No.  band energies     occupation 
      1      -4.8508      2.00000
      2      -2.6808      2.00000
      3       4.6241      2.00000
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 k-point    89 :      -0.2917    0.2083    0.1250
  band No.  band energies     occupation 
      1      -6.3301      2.00000
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      3       4.8033      2.00000
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 k-point    90 :      -0.2083    0.2083    0.1250
  band No.  band energies     occupation 
      1      -7.9055      2.00000
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 k-point    91 :      -0.1250    0.2083    0.1250
  band No.  band energies     occupation 
      1      -9.1696      2.00000
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      3       5.4978      2.00000
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 k-point    92 :       0.2917    0.2917    0.1250
  band No.  band energies     occupation 
      1      -9.2972      2.00000
      2       4.2255      2.00000
      3       6.4978      2.00000
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 k-point    93 :       0.3750    0.2917    0.1250
  band No.  band energies     occupation 
      1      -8.4051      2.00000
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 k-point    94 :       0.4583    0.2917    0.1250
  band No.  band energies     occupation 
      1      -7.1558      2.00000
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 k-point    95 :      -0.4583    0.2917    0.1250
  band No.  band energies     occupation 
      1      -5.6065      2.00000
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     18      64.2935      0.00000
     19      65.0850      0.00000
     20      68.4816      0.00000

 k-point    96 :      -0.3750    0.2917    0.1250
  band No.  band energies     occupation 
      1      -4.1736      2.00000
      2      -2.0187      2.00000
      3       2.9880      2.00000
      4       4.7670      2.00000
      5      18.4509      0.00000
      6      20.5527      0.00000
      7      24.2836      0.00000
      8      24.9645      0.00000
      9      28.4114      0.00000
     10      34.3369      0.00000
     11      37.3696      0.00000
     12      40.8131      0.00000
     13      49.6351      0.00000
     14      52.7120      0.00000
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     16      59.7221      0.00000
     17      62.2079      0.00000
     18      64.2427      0.00000
     19      65.5229      0.00000
     20      66.8225      0.00000

 k-point    97 :      -0.2917    0.2917    0.1250
  band No.  band energies     occupation 
      1      -5.0666      2.00000
      2      -0.9461      2.00000
      3       2.7765      2.00000
      4       5.1722      2.00000
      5      18.8236      0.00000
      6      20.1111      0.00000
      7      23.8440      0.00000
      8      25.0053      0.00000
      9      28.8076      0.00000
     10      33.7178      0.00000
     11      36.8806      0.00000
     12      41.7801      0.00000
     13      49.6893      0.00000
     14      51.6135      0.00000
     15      53.5761      0.00000
     16      57.4166      0.00000
     17      64.1996      0.00000
     18      64.7272      0.00000
     19      65.6834      0.00000
     20      67.2064      0.00000

 k-point    98 :      -0.2083    0.2917    0.1250
  band No.  band energies     occupation 
      1      -6.6726      2.00000
      2       1.2560      2.00000
      3       2.8245      2.00000
      4       5.9663      2.00000
      5      18.7323      0.00000
      6      19.7559      0.00000
      7      22.7832      0.00000
      8      24.1378      0.00000
      9      30.6074      0.00000
     10      32.4864      0.00000
     11      36.6370      0.00000
     12      43.4966      0.00000
     13      47.3512      0.00000
     14      51.0386      0.00000
     15      52.7708      0.00000
     16      55.1202      0.00000
     17      61.2077      0.00000
     18      65.5221      0.00000
     19      66.6701      0.00000
     20      68.6629      0.00000

 k-point    99 :      -0.1250    0.2917    0.1250
  band No.  band energies     occupation 
      1      -8.0295      2.00000
      2       2.6647      2.00000
      3       4.1055      2.00000
      4       6.8640      2.00000
      5      17.4652      0.00000
      6      20.3133      0.00000
      7      22.3747      0.00000
      8      22.7294      0.00000
      9      31.6525      0.00000
     10      31.8477      0.00000
     11      36.3729      0.00000
     12      43.2054      0.00000
     13      45.8794      0.00000
     14      50.2207      0.00000
     15      52.2513      0.00000
     16      55.4706      0.00000
     17      56.2720      0.00000
     18      64.6611      0.00000
     19      66.0206      0.00000
     20      69.4893      0.00000

 k-point   100 :       0.3750    0.3750    0.1250
  band No.  band energies     occupation 
      1      -7.6468      2.00000
      2       2.6645      2.00000
      3       4.9029      2.00000
      4       5.2197      2.00000
      5      15.4790      0.00000
      6      19.6499      0.00000
      7      23.3977      0.00000
      8      23.5068      0.00000
      9      32.1956      0.00000
     10      32.9272      0.00000
     11      40.1688      0.00000
     12      42.4267      0.00000
     13      47.3067      0.00000
     14      49.9810      0.00000
     15      50.2660      0.00000
     16      53.5601      0.00000
     17      56.8291      0.00000
     18      61.7532      0.00000
     19      67.1865      0.00000
     20      72.4181      0.00000

 k-point   101 :       0.4583    0.3750    0.1250
  band No.  band energies     occupation 
      1      -6.5304      2.00000
      2       1.8077      2.00000
      3       3.5673      2.00000
      4       4.5450      2.00000
      5      16.0118      0.00000
      6      18.9019      0.00000
      7      23.6524      0.00000
      8      25.1452      0.00000
      9      32.4845      0.00000
     10      32.9322      0.00000
     11      40.1899      0.00000
     12      43.9859      0.00000
     13      47.3247      0.00000
     14      49.6254      0.00000
     15      51.5983      0.00000
     16      56.8729      0.00000
     17      57.4895      0.00000
     18      60.2299      0.00000
     19      67.7547      0.00000
     20      68.9193      0.00000

 k-point   102 :      -0.4583    0.3750    0.1250
  band No.  band energies     occupation 
      1      -5.0993      2.00000
      2       0.5186      2.00000
      3       2.5195      2.00000
      4       3.7256      2.00000
      5      17.2354      0.00000
      6      19.2413      0.00000
      7      23.4936      0.00000
      8      26.0149      0.00000
      9      31.4099      0.00000
     10      33.2799      0.00000
     11      39.8047      0.00000
     12      43.0138      0.00000
     13      49.6446      0.00000
     14      50.5128      0.00000
     15      53.5772      0.00000
     16      57.8981      0.00000
     17      60.6628      0.00000
     18      62.0308      0.00000
     19      63.5669      0.00000
     20      66.3059      0.00000

 k-point   103 :      -0.3750    0.3750    0.1250
  band No.  band energies     occupation 
      1      -3.5483      2.00000
      2      -1.0339      2.00000
      3       1.5678      2.00000
      4       3.6551      2.00000
      5      17.8238      0.00000
      6      21.2192      0.00000
      7      23.2009      0.00000
      8      25.5840      0.00000
      9      29.8385      0.00000
     10      33.7471      0.00000
     11      38.6547      0.00000
     12      42.6544      0.00000
     13      51.1658      0.00000
     14      52.0286      0.00000
     15      56.5954      0.00000
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     17      59.9784      0.00000
     18      62.3943      0.00000
     19      63.8925      0.00000
     20      66.5086      0.00000

 k-point   104 :      -0.2917    0.3750    0.1250
  band No.  band energies     occupation 
      1      -3.6252      2.00000
      2      -0.8840      2.00000
      3       0.9739      2.00000
      4       4.1732      2.00000
      5      18.3310      0.00000
      6      21.8801      0.00000
      7      24.2484      0.00000
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      9      28.6655      0.00000
     10      33.7215      0.00000
     11      37.3834      0.00000
     12      43.3138      0.00000
     13      50.7853      0.00000
     14      52.5203      0.00000
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     17      61.8422      0.00000
     18      62.8384      0.00000
     19      64.1712      0.00000
     20      67.1074      0.00000

 k-point   105 :      -0.2083    0.3750    0.1250
  band No.  band energies     occupation 
      1      -5.1520      2.00000
      2       0.0551      2.00000
      3       1.7388      2.00000
      4       5.0385      2.00000
      5      18.9760      0.00000
      6      20.3282      0.00000
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      8      25.2674      0.00000
      9      28.8354      0.00000
     10      33.2480      0.00000
     11      36.8723      0.00000
     12      43.2920      0.00000
     13      49.1767      0.00000
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     17      64.1966      0.00000
     18      64.3386      0.00000
     19      66.3774      0.00000
     20      66.9053      0.00000

 k-point   106 :      -0.1250    0.3750    0.1250
  band No.  band energies     occupation 
      1      -6.5568      2.00000
      2       0.2356      2.00000
      3       3.8248      2.00000
      4       6.0270      2.00000
      5      18.2932      0.00000
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     10      32.9799      0.00000
     11      36.7026      0.00000
     12      41.6284      0.00000
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     17      61.5180      0.00000
     18      65.8310      0.00000
     19      66.7254      0.00000
     20      68.5128      0.00000

 k-point   107 :       0.4583    0.4583    0.1250
  band No.  band energies     occupation 
      1      -5.5505      2.00000
      2       0.7734      2.00000
      3       3.0810      2.00000
      4       4.3660      2.00000
      5      15.2636      0.00000
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     10      33.7069      0.00000
     11      41.0876      0.00000
     12      44.2098      0.00000
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     14      50.8903      0.00000
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     17      57.5440      0.00000
     18      58.9585      0.00000
     19      64.8540      0.00000
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 k-point   108 :      -0.4583    0.4583    0.1250
  band No.  band energies     occupation 
      1      -4.2520      2.00000
      2      -0.4177      2.00000
      3       2.7166      2.00000
      4       3.5185      2.00000
      5      16.0537      0.00000
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      9      32.4550      0.00000
     10      33.4386      0.00000
     11      41.0847      0.00000
     12      43.0250      0.00000
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     17      59.9252      0.00000
     18      61.5681      0.00000
     19      61.9059      0.00000
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 k-point   109 :      -0.3750    0.4583    0.1250
  band No.  band energies     occupation 
      1      -2.7479      2.00000
      2      -1.5365      2.00000
      3       1.9554      2.00000
      4       2.8907      2.00000
      5      17.3146      0.00000
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      9      31.8160      0.00000
     10      33.0405      0.00000
     11      40.5447      0.00000
     12      42.3532      0.00000
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     17      59.2951      0.00000
     18      61.3953      0.00000
     19      63.1756      0.00000
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 k-point   110 :      -0.2917    0.4583    0.1250
  band No.  band energies     occupation 
      1      -2.6655      2.00000
      2      -1.3918      2.00000
      3       0.9037      2.00000
      4       3.4398      2.00000
      5      17.7622      0.00000
      6      21.1945      0.00000
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      8      25.1491      0.00000
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     10      33.5555      0.00000
     11      38.6454      0.00000
     12      43.1490      0.00000
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     17      58.7040      0.00000
     18      61.7127      0.00000
     19      63.5107      0.00000
     20      66.6328      0.00000

 k-point   111 :      -0.2083    0.4583    0.1250
  band No.  band energies     occupation 
      1      -3.7424      2.00000
      2      -1.6156      2.00000
      3       1.9575      2.00000
      4       4.3540      2.00000
      5      18.3761      0.00000
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     10      34.0361      0.00000
     11      37.4077      0.00000
     12      42.1918      0.00000
     13      50.7659      0.00000
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     17      61.8046      0.00000
     18      63.6785      0.00000
     19      64.3225      0.00000
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 k-point   112 :      -0.1250    0.4583    0.1250
  band No.  band energies     occupation 
      1      -4.9279      2.00000
      2      -1.9345      2.00000
      3       3.8096      2.00000
      4       5.4633      2.00000
      5      18.5183      0.00000
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     10      34.3258      0.00000
     11      36.8865      0.00000
     12      40.0087      0.00000
     13      48.5295      0.00000
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     18      65.3895      0.00000
     19      65.7108      0.00000
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 k-point   113 :      -0.4583   -0.4583    0.1250
  band No.  band energies     occupation 
      1      -3.0955      2.00000
      2      -1.7736      2.00000
      3       2.4264      2.00000
      4       3.9936      2.00000
      5      15.2461      0.00000
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     10      34.1899      0.00000
     11      40.2959      0.00000
     12      44.1307      0.00000
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     17      59.4120      0.00000
     18      61.7003      0.00000
     19      63.1583      0.00000
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 k-point   114 :      -0.3750   -0.4583    0.1250
  band No.  band energies     occupation 
      1      -2.9989      2.00000
      2      -1.7022      2.00000
      3       2.5397      2.00000
      4       3.3487      2.00000
      5      16.1436      0.00000
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      7      26.3062      0.00000
      8      26.7546      0.00000
      9      32.4693      0.00000
     10      33.4501      0.00000
     11      41.0088      0.00000
     12      42.7993      0.00000
     13      50.8337      0.00000
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     17      59.2796      0.00000
     18      61.8200      0.00000
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 k-point   115 :      -0.2917   -0.4583    0.1250
  band No.  band energies     occupation 
      1      -3.9462      2.00000
      2      -0.4230      2.00000
      3       2.1579      2.00000
      4       3.1461      2.00000
      5      17.2661      0.00000
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      7      24.4253      0.00000
      8      26.3097      0.00000
      9      31.5299      0.00000
     10      33.2531      0.00000
     11      40.3468      0.00000
     12      42.5869      0.00000
     13      51.3061      0.00000
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     15      54.7497      0.00000
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     17      60.1873      0.00000
     18      61.4786      0.00000
     19      63.7951      0.00000
     20      64.1112      0.00000

 k-point   116 :      -0.2083   -0.4583    0.1250
  band No.  band energies     occupation 
      1      -4.5856      2.00000
      2      -0.6818      2.00000
      3       2.4422      2.00000
      4       4.1541      2.00000
      5      17.9409      0.00000
      6      21.0876      0.00000
      7      22.7355      0.00000
      8      25.5165      0.00000
      9      29.7568      0.00000
     10      33.8207      0.00000
     11      38.4491      0.00000
     12      42.0392      0.00000
     13      49.8352      0.00000
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     17      62.2118      0.00000
     18      62.7635      0.00000
     19      64.8267      0.00000
     20      66.6010      0.00000

 k-point   117 :      -0.3750   -0.3750    0.1250
  band No.  band energies     occupation 
      1      -4.3592      2.00000
      2      -0.4610      2.00000
      3       2.6302      2.00000
      4       4.1176      2.00000
      5      15.2409      0.00000
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      7      26.2590      0.00000
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      9      32.4066      0.00000
     10      34.0265      0.00000
     11      40.6561      0.00000
     12      44.2389      0.00000
     13      48.0515      0.00000
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     17      59.3229      0.00000
     18      60.7257      0.00000
     19      62.0636      0.00000
     20      66.1342      0.00000

 k-point   118 :      -0.2917   -0.3750    0.1250
  band No.  band energies     occupation 
      1      -5.4357      2.00000
      2       0.7807      2.00000
      3       3.0702      2.00000
      4       3.8931      2.00000
      5      15.9961      0.00000
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     10      33.2677      0.00000
     11      40.9179      0.00000
     12      43.4756      0.00000
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     14      50.2857      0.00000
     15      53.1991      0.00000
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     17      58.7860      0.00000
     18      59.3283      0.00000
     19      64.6828      0.00000
     20      67.0233      0.00000

 k-point   119 :      -0.2083   -0.3750    0.1250
  band No.  band energies     occupation 
      1      -6.1751      2.00000
      2       1.2828      2.00000
      3       2.9736      2.00000
      4       4.6413      2.00000
      5      17.2608      0.00000
      6      19.8868      0.00000
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      8      25.1862      0.00000
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     10      33.0107      0.00000
     11      38.8534      0.00000
     12      43.5031      0.00000
     13      47.9793      0.00000
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     17      59.9213      0.00000
     18      62.1795      0.00000
     19      66.7701      0.00000
     20      68.1872      0.00000

 k-point   120 :      -0.2917   -0.2917    0.1250
  band No.  band energies     occupation 
      1      -6.6504      2.00000
      2       1.8185      2.00000
      3       3.8499      2.00000
      4       4.7348      2.00000
      5      15.3399      0.00000
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      8      24.6649      0.00000
      9      32.5010      0.00000
     10      33.3089      0.00000
     11      41.0096      0.00000
     12      43.6245      0.00000
     13      46.7135      0.00000
     14      50.0916      0.00000
     15      51.6538      0.00000
     16      55.4485      0.00000
     17      57.6383      0.00000
     18      59.3509      0.00000
     19      67.6450      0.00000
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 k-point   121 :      -0.2083   -0.2917    0.1250
  band No.  band energies     occupation 
      1      -7.5233      2.00000
      2       2.6644      2.00000
      3       4.1443      2.00000
      4       5.4855      2.00000
      5      16.1031      0.00000
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     10      32.5885      0.00000
     11      38.9950      0.00000
     12      43.8908      0.00000
     13      46.3513      0.00000
     14      49.8268      0.00000
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     17      56.6572      0.00000
     18      62.4650      0.00000
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 k-point   122 :      -0.2083   -0.2083    0.1250
  band No.  band energies     occupation 
      1      -8.5311      2.00000
      2       3.4357      2.00000
      3       5.8106      2.00000
      4       6.0695      2.00000
      5      15.6710      0.00000
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      7      22.2296      0.00000
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     10      32.5249      0.00000
     11      38.9355      0.00000
     12      41.0130      0.00000
     13      47.1940      0.00000
     14      49.9287      0.00000
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     17      56.4346      0.00000
     18      64.0262      0.00000
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 k-point   123 :       0.2083    0.2083    0.2083
  band No.  band energies     occupation 
      1     -10.3296      2.00000
      2       4.9801      2.00000
      3       8.7989      2.00000
      4       8.7989      2.00000
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 k-point   124 :       0.2917    0.2083    0.2083
  band No.  band energies     occupation 
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 k-point   125 :       0.3750    0.2083    0.2083
  band No.  band energies     occupation 
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 k-point   126 :       0.4583    0.2083    0.2083
  band No.  band energies     occupation 
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 k-point   127 :      -0.4583    0.2083    0.2083
  band No.  band energies     occupation 
      1      -6.0974      2.00000
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 k-point   128 :      -0.3750    0.2083    0.2083
  band No.  band energies     occupation 
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 k-point   129 :      -0.2917    0.2083    0.2083
  band No.  band energies     occupation 
      1      -5.5236      2.00000
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 k-point   130 :      -0.2083    0.2083    0.2083
  band No.  band energies     occupation 
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 k-point   131 :       0.2917    0.2917    0.2083
  band No.  band energies     occupation 
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 k-point   132 :       0.3750    0.2917    0.2083
  band No.  band energies     occupation 
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 k-point   133 :       0.4583    0.2917    0.2083
  band No.  band energies     occupation 
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 k-point   134 :      -0.4583    0.2917    0.2083
  band No.  band energies     occupation 
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 k-point   135 :      -0.3750    0.2917    0.2083
  band No.  band energies     occupation 
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 k-point   136 :      -0.2917    0.2917    0.2083
  band No.  band energies     occupation 
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 k-point   137 :      -0.2083    0.2917    0.2083
  band No.  band energies     occupation 
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 k-point   138 :       0.3750    0.3750    0.2083
  band No.  band energies     occupation 
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 k-point   139 :       0.4583    0.3750    0.2083
  band No.  band energies     occupation 
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 k-point   140 :      -0.4583    0.3750    0.2083
  band No.  band energies     occupation 
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 k-point   141 :      -0.3750    0.3750    0.2083
  band No.  band energies     occupation 
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 k-point   142 :      -0.2917    0.3750    0.2083
  band No.  band energies     occupation 
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 k-point   143 :      -0.2083    0.3750    0.2083
  band No.  band energies     occupation 
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 k-point   144 :       0.4583    0.4583    0.2083
  band No.  band energies     occupation 
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 k-point   145 :      -0.4583    0.4583    0.2083
  band No.  band energies     occupation 
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 k-point   146 :      -0.3750    0.4583    0.2083
  band No.  band energies     occupation 
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 k-point   147 :      -0.2917    0.4583    0.2083
  band No.  band energies     occupation 
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 k-point   148 :      -0.2083    0.4583    0.2083
  band No.  band energies     occupation 
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 k-point   149 :      -0.4583   -0.4583    0.2083
  band No.  band energies     occupation 
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 k-point   150 :      -0.3750   -0.4583    0.2083
  band No.  band energies     occupation 
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 k-point   151 :      -0.2917   -0.4583    0.2083
  band No.  band energies     occupation 
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 k-point   152 :      -0.3750   -0.3750    0.2083
  band No.  band energies     occupation 
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 k-point   153 :      -0.2917   -0.3750    0.2083
  band No.  band energies     occupation 
      1      -3.8715      2.00000
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 k-point   154 :      -0.2917   -0.2917    0.2083
  band No.  band energies     occupation 
      1      -5.1107      2.00000
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 k-point   155 :       0.2917    0.2917    0.2917
  band No.  band energies     occupation 
      1      -9.1722      2.00000
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 k-point   156 :       0.3750    0.2917    0.2917
  band No.  band energies     occupation 
      1      -8.5377      2.00000
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 k-point   157 :       0.4583    0.2917    0.2917
  band No.  band energies     occupation 
      1      -7.5379      2.00000
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 k-point   158 :      -0.4583    0.2917    0.2917
  band No.  band energies     occupation 
      1      -6.2051      2.00000
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 k-point   159 :      -0.3750    0.2917    0.2917
  band No.  band energies     occupation 
      1      -4.6391      2.00000
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 k-point   160 :      -0.2917    0.2917    0.2917
  band No.  band energies     occupation 
      1      -3.7214      2.00000
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 k-point   161 :       0.3750    0.3750    0.2917
  band No.  band energies     occupation 
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 k-point   162 :       0.4583    0.3750    0.2917
  band No.  band energies     occupation 
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 k-point   163 :      -0.4583    0.3750    0.2917
  band No.  band energies     occupation 
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 k-point   164 :      -0.3750    0.3750    0.2917
  band No.  band energies     occupation 
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 k-point   165 :      -0.2917    0.3750    0.2917
  band No.  band energies     occupation 
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 k-point   166 :       0.4583    0.4583    0.2917
  band No.  band energies     occupation 
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 k-point   167 :      -0.4583    0.4583    0.2917
  band No.  band energies     occupation 
      1      -5.4082      2.00000
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 k-point   168 :      -0.3750    0.4583    0.2917
  band No.  band energies     occupation 
      1      -4.1314      2.00000
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 k-point   169 :      -0.2917    0.4583    0.2917
  band No.  band energies     occupation 
      1      -2.8130      2.00000
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 k-point   170 :      -0.4583   -0.4583    0.2917
  band No.  band energies     occupation 
      1      -4.5668      2.00000
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 k-point   171 :      -0.3750   -0.4583    0.2917
  band No.  band energies     occupation 
      1      -3.6130      2.00000
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 k-point   172 :      -0.3750   -0.3750    0.2917
  band No.  band energies     occupation 
      1      -3.2631      2.00000
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 k-point   173 :       0.3750    0.3750    0.3750
  band No.  band energies     occupation 
      1      -7.6689      2.00000
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 k-point   174 :       0.4583    0.3750    0.3750
  band No.  band energies     occupation 
      1      -6.9426      2.00000
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 k-point   175 :      -0.4583    0.3750    0.3750
  band No.  band energies     occupation 
      1      -5.8932      2.00000
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 k-point   176 :      -0.3750    0.3750    0.3750
  band No.  band energies     occupation 
      1      -4.6027      2.00000
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 k-point   177 :       0.4583    0.4583    0.3750
  band No.  band energies     occupation 
      1      -6.3693      2.00000
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 k-point   178 :      -0.4583    0.4583    0.3750
  band No.  band energies     occupation 
      1      -5.5100      2.00000
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      3       5.4400      2.00000
      4       6.5170      2.00000
      5      18.4285      0.00000
      6      19.5429      0.00000
      7      21.7712      0.00000
      8      25.7260      0.00000
      9      30.3695      0.00000
     10      34.5819      0.00000
     11      36.1892      0.00000
     12      38.2158      0.00000
     13      46.5460      0.00000
     14      49.2043      0.00000
     15      54.8998      0.00000
     16      60.4584      0.00000
     17      64.3737      0.00000
     18      66.5674      0.00000
     19      67.6136      0.00000
     20      68.6513      0.00000

 k-point   179 :      -0.3750    0.4583    0.3750
  band No.  band energies     occupation 
      1      -4.5154      2.00000
      2      -2.3322      2.00000
      3       3.5413      2.00000
      4       5.5593      2.00000
      5      18.0403      0.00000
      6      20.6259      0.00000
      7      23.7549      0.00000
      8      25.3936      0.00000
      9      28.5989      0.00000
     10      34.5500      0.00000
     11      36.3602      0.00000
     12      40.2947      0.00000
     13      48.9131      0.00000
     14      51.7939      0.00000
     15      53.4562      0.00000
     16      60.2999      0.00000
     17      63.3413      0.00000
     18      64.8076      0.00000
     19      65.8408      0.00000
     20      67.5328      0.00000

 k-point   180 :      -0.4583   -0.4583    0.3750
  band No.  band energies     occupation 
      1      -4.9634      2.00000
      2      -2.8002      2.00000
      3       4.8736      2.00000
      4       6.3019      2.00000
      5      17.6164      0.00000
      6      20.8911      0.00000
      7      21.9874      0.00000
      8      25.4839      0.00000
      9      30.0741      0.00000
     10      34.9700      0.00000
     11      36.0383      0.00000
     12      38.7419      0.00000
     13      46.7196      0.00000
     14      49.9720      0.00000
     15      54.9042      0.00000
     16      61.9938      0.00000
     17      62.7153      0.00000
     18      66.3831      0.00000
     19      66.7750      0.00000
     20      68.2574      0.00000

 k-point   181 :       0.4583    0.4583    0.4583
  band No.  band energies     occupation 
      1      -5.9813      2.00000
      2      -2.9645      2.00000
      3       7.3859      2.00000
      4       7.3859      2.00000
      5      18.7684      0.00000
      6      18.7684      0.00000
      7      19.6869      0.00000
      8      25.9688      0.00000
      9      32.2096      0.00000
     10      34.9977      0.00000
     11      36.1986      0.00000
     12      36.1986      0.00000
     13      45.3103      0.00000
     14      45.3103      0.00000
     15      56.7416      0.00000
     16      63.2296      0.00000
     17      63.2296      0.00000
     18      67.5112      0.00000
     19      69.0601      0.00000
     20      69.0601      0.00000

 k-point   182 :      -0.4583    0.4583    0.4583
  band No.  band energies     occupation 
      1      -5.4238      2.00000
      2      -3.2763      2.00000
      3       6.5697      2.00000
      4       7.1121      2.00000
      5      18.5420      0.00000
      6      19.2877      0.00000
      7      20.3087      0.00000
      8      26.0356      0.00000
      9      31.5586      0.00000
     10      34.9755      0.00000
     11      35.8892      0.00000
     12      37.1729      0.00000
     13      45.8059      0.00000
     14      46.1151      0.00000
     15      56.3483      0.00000
     16      63.0589      0.00000
     17      64.4943      0.00000
     18      67.4242      0.00000
     19      68.6848      0.00000
     20      69.3206      0.00000


--------------------------------------------------------------------------------------------------------


 soft charge-density along one line, spin component           1
         0         1         2         3         4         5         6         7         8         9
 total charge-density along one line
 
 pseudopotential strength for first ion, spin component:           1
  9.914  13.281  -0.000  -0.000  -0.000   0.000   0.000   0.000
 13.281  17.792  -0.000  -0.000  -0.000   0.000   0.000   0.000
 -0.000  -0.000  -3.506   0.000   0.000   6.763  -0.000  -0.000
 -0.000  -0.000   0.000  -3.506   0.000  -0.000   6.763  -0.000
 -0.000  -0.000   0.000   0.000  -3.506  -0.000  -0.000   6.763
  0.000   0.000   6.763  -0.000  -0.000 -15.944   0.000   0.000
  0.000   0.000  -0.000   6.763  -0.000   0.000 -15.944   0.000
  0.000   0.000  -0.000  -0.000   6.763   0.000   0.000 -15.944
 total augmentation occupancy for first ion, spin component:           1
  7.911  -3.522   0.000   0.000   0.000   0.000   0.000   0.000
 -3.522   1.642   0.000  -0.000  -0.000  -0.000   0.000   0.000
 -0.000  -0.000   1.621   0.000   0.000   0.142   0.000   0.000
  0.000  -0.000   0.000   1.621   0.000   0.000   0.142  -0.000
  0.000  -0.000   0.000  -0.000   1.621  -0.000  -0.000   0.142
  0.000   0.000   0.142  -0.000   0.000   0.014   0.000  -0.000
  0.000   0.000   0.000   0.142  -0.000   0.000   0.014  -0.000
  0.000   0.000  -0.000   0.000   0.142   0.000  -0.000   0.014


------------------------ aborting loop because EDIFF is reached ----------------------------------------


 


 total charge     
 
# of ion     s       p       d       tot
----------------------------------------
  1        0.829   1.793   0.000   2.622
  2        0.829   1.793   0.000   2.622
------------------------------------------------
tot        1.658   3.587   0.000   5.245
 
    CHARGE:  cpu time    0.0090: real time    0.0090
    FORLOC:  cpu time    0.0010: real time    0.0004
    FORNL :  cpu time    0.0040: real time    0.0046
    STRESS:  cpu time    0.0940: real time    0.0937
    FORCOR:  cpu time    0.0010: real time    0.0007
    FORHAR:  cpu time    0.0000: real time    0.0006
    MIXING:  cpu time    0.0010: real time    0.0003
    OFIELD:  cpu time    0.0000: real time    0.0000

  FORCE on cell =-STRESS in cart. coord.  units (eV):
  Direction    XX          YY          ZZ          XY          YZ          ZX
  --------------------------------------------------------------------------------------
  Alpha Z    27.93469    27.93469    27.93469
  Ewald    -117.31802  -117.31802  -117.31802     0.00000     0.00000    -0.00000
  Hartree     8.57007     8.57007     8.57007     0.00000     0.00000     0.00000
  E(xc)     -30.28166   -30.28166   -30.28166     0.00000     0.00000     0.00000
  Local     -12.38241   -12.38241   -12.38241     0.00002     0.00002     0.00002
  n-local    -4.84100    -3.81029    -5.49563    -0.09088     0.09164    -0.00075
  augment    -0.25657    -0.25657    -0.25657    -0.00002    -0.00002    -0.00002
  Kinetic   131.16669   123.68431   130.49919     1.19674    -1.21539     0.01836
  Fock        0.00000     0.00000     0.00000     0.00000     0.00000     0.00000
  -------------------------------------------------------------------------------------
  Total       0.00052     0.00052     0.00052     0.00000     0.00000     0.00000
  in kB       0.07620     0.07620     0.07620     0.00000     0.00000     0.00000
  external pressure =        0.08 kB  Pullay stress =        0.00 kB


 VOLUME and BASIS-vectors are now :
 -----------------------------------------------------------------------------
  energy-cutoff  :      400.00
  volume of cell :       10.96
      direct lattice vectors                 reciprocal lattice vectors
     0.000000000  1.763156895  1.763156895    -0.283582250  0.283582250  0.283582250
     1.763156895  0.000000000  1.763156895     0.283582250 -0.283582250  0.283582250
     1.763156895  1.763156895  0.000000000     0.283582250  0.283582250 -0.283582250

  length of vectors
     2.493480393  2.493480393  2.493480393     0.491178866  0.491178866  0.491178866


 FORCES acting on ions
    electron-ion (+dipol)            ewald-force                    non-local-force                 convergence-correction
 -----------------------------------------------------------------------------------------------
   -.578E-06 -.578E-06 -.129E-06   -.728E-15 0.433E-14 -.401E-14   -.312E-16 -.278E-16 -.231E-16   -.129E-08 -.129E-08 -.129E-08
   0.578E-06 0.578E-06 0.129E-06   0.392E-15 -.418E-14 0.538E-14   0.208E-16 0.278E-16 0.297E-16   0.129E-08 0.129E-08 0.129E-08
 -----------------------------------------------------------------------------------------------
   0.391E-13 0.471E-13 0.581E-13   -.336E-15 0.154E-15 0.138E-14   -.104E-16 0.000E+00 0.651E-17   0.102E-13 0.150E-13 -.470E-15
 
 
 POSITION                                       TOTAL-FORCE (eV/Angst)
 -----------------------------------------------------------------------------------
      0.00000      0.00000      0.00000         0.000000      0.000000      0.000000
      0.88158      0.88158      0.88158        -0.000000     -0.000000     -0.000000
 -----------------------------------------------------------------------------------
    total drift:                                0.000000      0.000000      0.000000


--------------------------------------------------------------------------------------------------------



  FREE ENERGIE OF THE ION-ELECTRON SYSTEM (eV)
  ---------------------------------------------------
  free  energy   TOTEN  =       -20.25773584 eV

  energy  without entropy=      -20.25773584  energy(sigma->0) =      -20.25773584
 


--------------------------------------------------------------------------------------------------------


    POTLOK:  cpu time    0.0010: real time    0.0017


--------------------------------------------------------------------------------------------------------


 
 Found     1 degrees of freedom:
  ----------------------------------------------
 
     directions for atom     1:  x 
 Linear response reoptimize wavefunctions
 Linear response G [H, r] |phi>, progress :
  Direction:   1


----------------------------------------- Iteration    1(   1)  ---------------------------------------


    HAMIL1:  cpu time    0.0120: real time    0.0130
    LRDIAG:  cpu time    0.0280: real time    0.0284
    LRDIIS:  cpu time    0.0760: real time    0.0757
    --------------------------------------------
      LOOP:  cpu time    0.1160: real time    0.1172

  free energy    TOTEN  =       -31.97687042 eV
  ---------------------------------------------------


----------------------------------------- Iteration    1(   2)  ---------------------------------------


    HAMIL1:  cpu time    0.0140: real time    0.0215
    LRDIAG:  cpu time    0.0280: real time    0.0286
    LRDIIS:  cpu time    0.0660: real time    0.0660
    --------------------------------------------
      LOOP:  cpu time    0.1080: real time    0.1175

  free energy    TOTEN  =       -30.55816446 eV
  ---------------------------------------------------


----------------------------------------- Iteration    1(   3)  ---------------------------------------


    HAMIL1:  cpu time    0.0140: real time    0.0185
    LRDIAG:  cpu time    0.0270: real time    0.0279
    LRDIIS:  cpu time    0.0770: real time    0.0766
    --------------------------------------------
      LOOP:  cpu time    0.1180: real time    0.1229

  free energy    TOTEN  =       -30.56055644 eV
  ---------------------------------------------------


----------------------------------------- Iteration    1(   4)  ---------------------------------------


    LRDIAG:  cpu time    0.0280: real time    0.0337
    LRDIIS:  cpu time    0.0760: real time    0.0766
    --------------------------------------------
      LOOP:  cpu time    0.1040: real time    0.1103

  free energy    TOTEN  =       -30.56056308 eV
  ---------------------------------------------------


----------------------------------------- Iteration    1(   5)  ---------------------------------------


    LRDIAG:  cpu time    0.0280: real time    0.0337
    LRDIIS:  cpu time    0.0770: real time    0.0766
    --------------------------------------------
      LOOP:  cpu time    0.1050: real time    0.1103

  free energy    TOTEN  =       -30.56056310 eV
  ---------------------------------------------------


----------------------------------------- Iteration    1(   6)  ---------------------------------------


    LRDIAG:  cpu time    0.0270: real time    0.0337
    LRDIIS:  cpu time    0.0780: real time    0.0780
    --------------------------------------------
      LOOP:  cpu time    0.1050: real time    0.1117

  free energy    TOTEN  =       -30.56056310 eV
  ---------------------------------------------------


------------------------ aborting loop because EDIFF is reached ----------------------------------------




--------------------------------------------------------------------------------------------------------


 Linear response G [H, r] |phi>, progress :
  Direction:   2


----------------------------------------- Iteration    2(   1)  ---------------------------------------


    HAMIL1:  cpu time    0.0120: real time    0.0128
    LRDIAG:  cpu time    0.0290: real time    0.0282
    LRDIIS:  cpu time    0.0770: real time    0.0778
    --------------------------------------------
      LOOP:  cpu time    0.1190: real time    0.1190

  free energy    TOTEN  =       -35.61985608 eV
  ---------------------------------------------------


----------------------------------------- Iteration    2(   2)  ---------------------------------------


    HAMIL1:  cpu time    0.0150: real time    0.0183
    LRDIAG:  cpu time    0.0280: real time    0.0282
    LRDIIS:  cpu time    0.0700: real time    0.0697
    --------------------------------------------
      LOOP:  cpu time    0.1120: real time    0.1177

  free energy    TOTEN  =       -32.94605777 eV
  ---------------------------------------------------


----------------------------------------- Iteration    2(   3)  ---------------------------------------


    HAMIL1:  cpu time    0.0120: real time    0.0187
    LRDIAG:  cpu time    0.0280: real time    0.0279
    LRDIIS:  cpu time    0.0790: real time    0.0785
    --------------------------------------------
      LOOP:  cpu time    0.1190: real time    0.1251

  free energy    TOTEN  =       -32.94735433 eV
  ---------------------------------------------------


----------------------------------------- Iteration    2(   4)  ---------------------------------------


    LRDIAG:  cpu time    0.0280: real time    0.0336
    LRDIIS:  cpu time    0.0780: real time    0.0781
    --------------------------------------------
      LOOP:  cpu time    0.1070: real time    0.1117

  free energy    TOTEN  =       -32.94735758 eV
  ---------------------------------------------------


----------------------------------------- Iteration    2(   5)  ---------------------------------------


    LRDIAG:  cpu time    0.0290: real time    0.0337
    LRDIIS:  cpu time    0.0770: real time    0.0771
    --------------------------------------------
      LOOP:  cpu time    0.1050: real time    0.1108

  free energy    TOTEN  =       -32.94735759 eV
  ---------------------------------------------------


----------------------------------------- Iteration    2(   6)  ---------------------------------------


    LRDIAG:  cpu time    0.0280: real time    0.0338
    LRDIIS:  cpu time    0.0770: real time    0.0773
    --------------------------------------------
      LOOP:  cpu time    0.1050: real time    0.1109

  free energy    TOTEN  =       -32.94735759 eV
  ---------------------------------------------------


------------------------ aborting loop because EDIFF is reached ----------------------------------------




--------------------------------------------------------------------------------------------------------


 Linear response G [H, r] |phi>, progress :
  Direction:   3


----------------------------------------- Iteration    3(   1)  ---------------------------------------


    HAMIL1:  cpu time    0.0130: real time    0.0129
    LRDIAG:  cpu time    0.0280: real time    0.0284
    LRDIIS:  cpu time    0.0780: real time    0.0772
    --------------------------------------------
      LOOP:  cpu time    0.1190: real time    0.1187

  free energy    TOTEN  =       -25.00809398 eV
  ---------------------------------------------------


----------------------------------------- Iteration    3(   2)  ---------------------------------------


    HAMIL1:  cpu time    0.0140: real time    0.0180
    LRDIAG:  cpu time    0.0280: real time    0.0284
    LRDIIS:  cpu time    0.0660: real time    0.0664
    --------------------------------------------
      LOOP:  cpu time    0.1080: real time    0.1142

  free energy    TOTEN  =       -24.13350682 eV
  ---------------------------------------------------


----------------------------------------- Iteration    3(   3)  ---------------------------------------


    HAMIL1:  cpu time    0.0130: real time    0.0186
    LRDIAG:  cpu time    0.0280: real time    0.0281
    LRDIIS:  cpu time    0.0770: real time    0.0769
    --------------------------------------------
      LOOP:  cpu time    0.1180: real time    0.1236

  free energy    TOTEN  =       -24.13485747 eV
  ---------------------------------------------------


----------------------------------------- Iteration    3(   4)  ---------------------------------------


    LRDIAG:  cpu time    0.0280: real time    0.0339
    LRDIIS:  cpu time    0.0760: real time    0.0766
    --------------------------------------------
      LOOP:  cpu time    0.1050: real time    0.1105

  free energy    TOTEN  =       -24.13485852 eV
  ---------------------------------------------------


----------------------------------------- Iteration    3(   5)  ---------------------------------------


    LRDIAG:  cpu time    0.0290: real time    0.0339
    LRDIIS:  cpu time    0.0760: real time    0.0761
    --------------------------------------------
      LOOP:  cpu time    0.1050: real time    0.1100

  free energy    TOTEN  =       -24.13485853 eV
  ---------------------------------------------------


------------------------ aborting loop because EDIFF is reached ----------------------------------------




--------------------------------------------------------------------------------------------------------


 Linear response to external field (no local field effect), progress :
  Direction:   1
  LATTYP: Found a face centered cubic cell.
 ALAT       =     3.5263137898
  
  Lattice vectors:
  
 A1 = (   0.0000000000,   1.7631568949,   1.7631568949)
 A2 = (   1.7631568949,   0.0000000000,   1.7631568949)
 A3 = (   1.7631568949,   1.7631568949,   0.0000000000)


Analysis of symmetry for initial positions (statically):
=====================================================================
 Subroutine PRICEL returns:
 Original cell was already a primitive cell.
 

 Routine SETGRP: Setting up the symmetry group for a 
 face centered cubic supercell.


 Subroutine GETGRP returns: Found 48 space group operations
 (whereof 24 operations were pure point group operations)
 out of a pool of 48 trial point group operations.


The static configuration has the point symmetry T_d .
 The point group associated with its full space group is O_h .


Analysis of symmetry for dynamics (positions and initial velocities):
=====================================================================
 Subroutine PRICEL returns:
 Original cell was already a primitive cell.
 

 Routine SETGRP: Setting up the symmetry group for a 
 face centered cubic supercell.


 Subroutine GETGRP returns: Found  8 space group operations
 (whereof  4 operations were pure point group operations)
 out of a pool of 48 trial point group operations.


The dynamic configuration has the point symmetry C_2v.
 The point group associated with its full space group is C_4v.


Analysis of constrained symmetry for selective dynamics:
=====================================================================
 Subroutine PRICEL returns:
 Original cell was already a primitive cell.
 

 Routine SETGRP: Setting up the symmetry group for a 
 face centered cubic supercell.


 Subroutine GETGRP returns: Found  8 space group operations
 (whereof  4 operations were pure point group operations)
 out of a pool of 48 trial point group operations.


The constrained configuration has the point symmetry C_2v.
 The point group associated with its full space group is C_4v.


----------------------------------------- Iteration    1(   1)  ---------------------------------------


   POT+DIJ:  cpu time    0.0030: real time    0.0035
    HAMIL1:  cpu time    0.0180: real time    0.0186
    LRDIAG:  cpu time    0.0290: real time    0.0285
    LRDIIS:  cpu time    0.0770: real time    0.0778
    LRDIAG:  cpu time    0.0280: real time    0.0280
    --------------------------------------------
      LOOP:  cpu time    0.1560: real time    0.1567

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  -Hartree energ DENC   =         0.00000000
  -V(xc)+E(xc)   XCENC  =         0.00000000
  PAW double counting   =         0.00000000        0.00000000
  entropy T*S    EENTRO =         0.00000000
  eigenvalues    EBANDS =        -0.15945462
  ---------------------------------------------------
  free energy    TOTEN  =        -0.15945462 eV

  energy without entropy =       -0.15945462


----------------------------------------- Iteration    1(   2)  ---------------------------------------


   POT+DIJ:  cpu time    0.0020: real time    0.0026
    HAMIL1:  cpu time    0.0190: real time    0.0182
    LRDIAG:  cpu time    0.0280: real time    0.0286
    LRDIIS:  cpu time    0.0680: real time    0.0676
    LRDIAG:  cpu time    0.0280: real time    0.0279
    --------------------------------------------
      LOOP:  cpu time    0.1450: real time    0.1520

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  -Hartree energ DENC   =         0.00000000
  -V(xc)+E(xc)   XCENC  =         0.00000000
  PAW double counting   =         0.00000000        0.00000000
  entropy T*S    EENTRO =         0.00000000
  eigenvalues    EBANDS =        -0.16282538
  ---------------------------------------------------
  free energy    TOTEN  =        -0.16282538 eV

  energy without entropy =       -0.16282538


----------------------------------------- Iteration    1(   3)  ---------------------------------------


   POT+DIJ:  cpu time    0.0020: real time    0.0026
    HAMIL1:  cpu time    0.0180: real time    0.0180
    LRDIAG:  cpu time    0.0290: real time    0.0285
    LRDIIS:  cpu time    0.0750: real time    0.0754
    LRDIAG:  cpu time    0.0280: real time    0.0280
    --------------------------------------------
      LOOP:  cpu time    0.1530: real time    0.1582

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  -Hartree energ DENC   =         0.00000000
  -V(xc)+E(xc)   XCENC  =         0.00000000
  PAW double counting   =         0.00000000        0.00000000
  entropy T*S    EENTRO =         0.00000000
  eigenvalues    EBANDS =        -0.16282598
  ---------------------------------------------------
  free energy    TOTEN  =        -0.16282598 eV

  energy without entropy =       -0.16282598


----------------------------------------- Iteration    1(   4)  ---------------------------------------


   POT+DIJ:  cpu time    0.0030: real time    0.0026
    HAMIL1:  cpu time    0.0180: real time    0.0181
    LRDIAG:  cpu time    0.0280: real time    0.0285
    LRDIIS:  cpu time    0.0760: real time    0.0757
    LRDIAG:  cpu time    0.0280: real time    0.0280
    --------------------------------------------
      LOOP:  cpu time    0.1530: real time    0.1590

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  -Hartree energ DENC   =         0.00000000
  -V(xc)+E(xc)   XCENC  =         0.00000000
  PAW double counting   =         0.00000000        0.00000000
  entropy T*S    EENTRO =         0.00000000
  eigenvalues    EBANDS =        -0.16282598
  ---------------------------------------------------
  free energy    TOTEN  =        -0.16282598 eV

  energy without entropy =       -0.16282598


------------------------ aborting loop because EDIFF is reached ----------------------------------------


 change of polarisation eV/A/(eV/A) component  1 :     0.326     0.060     0.001
 dielectric tensor                  component  1 :     6.375     0.987     0.024


--------------------------------------------------------------------------------------------------------


 Linear response to external field (no local field effect), progress :
  Direction:   2
  LATTYP: Found a face centered cubic cell.
 ALAT       =     3.5263137898
  
  Lattice vectors:
  
 A1 = (   0.0000000000,   1.7631568949,   1.7631568949)
 A2 = (   1.7631568949,   0.0000000000,   1.7631568949)
 A3 = (   1.7631568949,   1.7631568949,   0.0000000000)


Analysis of symmetry for initial positions (statically):
=====================================================================
 Subroutine PRICEL returns:
 Original cell was already a primitive cell.
 

 Routine SETGRP: Setting up the symmetry group for a 
 face centered cubic supercell.


 Subroutine GETGRP returns: Found 48 space group operations
 (whereof 24 operations were pure point group operations)
 out of a pool of 48 trial point group operations.


The static configuration has the point symmetry T_d .
 The point group associated with its full space group is O_h .


Analysis of symmetry for dynamics (positions and initial velocities):
=====================================================================
 Subroutine PRICEL returns:
 Original cell was already a primitive cell.
 

 Routine SETGRP: Setting up the symmetry group for a 
 face centered cubic supercell.


 Subroutine GETGRP returns: Found  8 space group operations
 (whereof  4 operations were pure point group operations)
 out of a pool of 48 trial point group operations.


The dynamic configuration has the point symmetry C_2v.
 The point group associated with its full space group is C_4v.


Analysis of constrained symmetry for selective dynamics:
=====================================================================
 Subroutine PRICEL returns:
 Original cell was already a primitive cell.
 

 Routine SETGRP: Setting up the symmetry group for a 
 face centered cubic supercell.


 Subroutine GETGRP returns: Found  8 space group operations
 (whereof  4 operations were pure point group operations)
 out of a pool of 48 trial point group operations.


The constrained configuration has the point symmetry C_2v.
 The point group associated with its full space group is C_4v.


----------------------------------------- Iteration    2(   1)  ---------------------------------------


   POT+DIJ:  cpu time    0.0030: real time    0.0033
    HAMIL1:  cpu time    0.0190: real time    0.0181
    LRDIAG:  cpu time    0.0280: real time    0.0283
    LRDIIS:  cpu time    0.0790: real time    0.0791
    LRDIAG:  cpu time    0.0280: real time    0.0280
    --------------------------------------------
      LOOP:  cpu time    0.1570: real time    0.1573

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  -Hartree energ DENC   =         0.00000000
  -V(xc)+E(xc)   XCENC  =         0.00000000
  PAW double counting   =         0.00000000        0.00000000
  entropy T*S    EENTRO =         0.00000000
  eigenvalues    EBANDS =        -0.17327524
  ---------------------------------------------------
  free energy    TOTEN  =        -0.17327524 eV

  energy without entropy =       -0.17327524


----------------------------------------- Iteration    2(   2)  ---------------------------------------


   POT+DIJ:  cpu time    0.0020: real time    0.0026
    HAMIL1:  cpu time    0.0190: real time    0.0181
    LRDIAG:  cpu time    0.0280: real time    0.0284
    LRDIIS:  cpu time    0.0710: real time    0.0707
    LRDIAG:  cpu time    0.0280: real time    0.0279
    --------------------------------------------
      LOOP:  cpu time    0.1480: real time    0.1551

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  -Hartree energ DENC   =         0.00000000
  -V(xc)+E(xc)   XCENC  =         0.00000000
  PAW double counting   =         0.00000000        0.00000000
  entropy T*S    EENTRO =         0.00000000
  eigenvalues    EBANDS =        -0.17687548
  ---------------------------------------------------
  free energy    TOTEN  =        -0.17687548 eV

  energy without entropy =       -0.17687548


----------------------------------------- Iteration    2(   3)  ---------------------------------------


   POT+DIJ:  cpu time    0.0030: real time    0.0026
    HAMIL1:  cpu time    0.0180: real time    0.0181
    LRDIAG:  cpu time    0.0280: real time    0.0284
    LRDIIS:  cpu time    0.0750: real time    0.0751
    LRDIAG:  cpu time    0.0280: real time    0.0280
    --------------------------------------------
      LOOP:  cpu time    0.1540: real time    0.1587

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  -Hartree energ DENC   =         0.00000000
  -V(xc)+E(xc)   XCENC  =         0.00000000
  PAW double counting   =         0.00000000        0.00000000
  entropy T*S    EENTRO =         0.00000000
  eigenvalues    EBANDS =        -0.17687603
  ---------------------------------------------------
  free energy    TOTEN  =        -0.17687603 eV

  energy without entropy =       -0.17687603


----------------------------------------- Iteration    2(   4)  ---------------------------------------


   POT+DIJ:  cpu time    0.0030: real time    0.0025
    HAMIL1:  cpu time    0.0180: real time    0.0181
    LRDIAG:  cpu time    0.0290: real time    0.0284
    LRDIIS:  cpu time    0.0750: real time    0.0758
    LRDIAG:  cpu time    0.0280: real time    0.0280
    --------------------------------------------
      LOOP:  cpu time    0.1540: real time    0.1589

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  -Hartree energ DENC   =         0.00000000
  -V(xc)+E(xc)   XCENC  =         0.00000000
  PAW double counting   =         0.00000000        0.00000000
  entropy T*S    EENTRO =         0.00000000
  eigenvalues    EBANDS =        -0.17687603
  ---------------------------------------------------
  free energy    TOTEN  =        -0.17687603 eV

  energy without entropy =       -0.17687603


------------------------ aborting loop because EDIFF is reached ----------------------------------------


 change of polarisation eV/A/(eV/A) component  2 :     0.060     0.354    -0.061
 dielectric tensor                  component  2 :     0.987     6.839    -1.015


--------------------------------------------------------------------------------------------------------


 Linear response to external field (no local field effect), progress :
  Direction:   3
  LATTYP: Found a face centered cubic cell.
 ALAT       =     3.5263137898
  
  Lattice vectors:
  
 A1 = (   0.0000000000,   1.7631568949,   1.7631568949)
 A2 = (   1.7631568949,   0.0000000000,   1.7631568949)
 A3 = (   1.7631568949,   1.7631568949,   0.0000000000)


Analysis of symmetry for initial positions (statically):
=====================================================================
 Subroutine PRICEL returns:
 Original cell was already a primitive cell.
 

 Routine SETGRP: Setting up the symmetry group for a 
 face centered cubic supercell.


 Subroutine GETGRP returns: Found 48 space group operations
 (whereof 24 operations were pure point group operations)
 out of a pool of 48 trial point group operations.


The static configuration has the point symmetry T_d .
 The point group associated with its full space group is O_h .


Analysis of symmetry for dynamics (positions and initial velocities):
=====================================================================
 Subroutine PRICEL returns:
 Original cell was already a primitive cell.
 

 Routine SETGRP: Setting up the symmetry group for a 
 face centered cubic supercell.


 Subroutine GETGRP returns: Found  8 space group operations
 (whereof  4 operations were pure point group operations)
 out of a pool of 48 trial point group operations.


The dynamic configuration has the point symmetry C_2v.
 The point group associated with its full space group is C_4v.


Analysis of constrained symmetry for selective dynamics:
=====================================================================
 Subroutine PRICEL returns:
 Original cell was already a primitive cell.
 

 Routine SETGRP: Setting up the symmetry group for a 
 face centered cubic supercell.


 Subroutine GETGRP returns: Found  8 space group operations
 (whereof  4 operations were pure point group operations)
 out of a pool of 48 trial point group operations.


The constrained configuration has the point symmetry C_2v.
 The point group associated with its full space group is C_4v.


----------------------------------------- Iteration    3(   1)  ---------------------------------------


   POT+DIJ:  cpu time    0.0040: real time    0.0035
    HAMIL1:  cpu time    0.0180: real time    0.0180
    LRDIAG:  cpu time    0.0280: real time    0.0285
    LRDIIS:  cpu time    0.0810: real time    0.0805
    LRDIAG:  cpu time    0.0280: real time    0.0280
    --------------------------------------------
      LOOP:  cpu time    0.1590: real time    0.1589

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  -Hartree energ DENC   =         0.00000000
  -V(xc)+E(xc)   XCENC  =         0.00000000
  PAW double counting   =         0.00000000        0.00000000
  entropy T*S    EENTRO =         0.00000000
  eigenvalues    EBANDS =        -0.10567845
  ---------------------------------------------------
  free energy    TOTEN  =        -0.10567845 eV

  energy without entropy =       -0.10567845


----------------------------------------- Iteration    3(   2)  ---------------------------------------


   POT+DIJ:  cpu time    0.0030: real time    0.0025
    HAMIL1:  cpu time    0.0180: real time    0.0182
    LRDIAG:  cpu time    0.0280: real time    0.0284
    LRDIIS:  cpu time    0.0680: real time    0.0683
    LRDIAG:  cpu time    0.0290: real time    0.0281
    --------------------------------------------
      LOOP:  cpu time    0.1460: real time    0.1521

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  -Hartree energ DENC   =         0.00000000
  -V(xc)+E(xc)   XCENC  =         0.00000000
  PAW double counting   =         0.00000000        0.00000000
  entropy T*S    EENTRO =         0.00000000
  eigenvalues    EBANDS =        -0.10816755
  ---------------------------------------------------
  free energy    TOTEN  =        -0.10816755 eV

  energy without entropy =       -0.10816755


----------------------------------------- Iteration    3(   3)  ---------------------------------------


   POT+DIJ:  cpu time    0.0020: real time    0.0025
    HAMIL1:  cpu time    0.0180: real time    0.0181
    LRDIAG:  cpu time    0.0290: real time    0.0285
    LRDIIS:  cpu time    0.0740: real time    0.0746
    LRDIAG:  cpu time    0.0280: real time    0.0280
    --------------------------------------------
      LOOP:  cpu time    0.1520: real time    0.1581

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  -Hartree energ DENC   =         0.00000000
  -V(xc)+E(xc)   XCENC  =         0.00000000
  PAW double counting   =         0.00000000        0.00000000
  entropy T*S    EENTRO =         0.00000000
  eigenvalues    EBANDS =        -0.10816791
  ---------------------------------------------------
  free energy    TOTEN  =        -0.10816791 eV

  energy without entropy =       -0.10816791


----------------------------------------- Iteration    3(   4)  ---------------------------------------


   POT+DIJ:  cpu time    0.0020: real time    0.0026
    HAMIL1:  cpu time    0.0190: real time    0.0183
    LRDIAG:  cpu time    0.0280: real time    0.0285
    LRDIIS:  cpu time    0.0770: real time    0.0767
    LRDIAG:  cpu time    0.0280: real time    0.0281
    --------------------------------------------
      LOOP:  cpu time    0.1550: real time    0.1602

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  -Hartree energ DENC   =         0.00000000
  -V(xc)+E(xc)   XCENC  =         0.00000000
  PAW double counting   =         0.00000000        0.00000000
  entropy T*S    EENTRO =         0.00000000
  eigenvalues    EBANDS =        -0.10816791
  ---------------------------------------------------
  free energy    TOTEN  =        -0.10816791 eV

  energy without entropy =       -0.10816791


------------------------ aborting loop because EDIFF is reached ----------------------------------------


 change of polarisation eV/A/(eV/A) component  3 :     0.001    -0.061     0.216
 dielectric tensor                  component  3 :     0.024    -1.015     4.571


--------------------------------------------------------------------------------------------------------


  LATTYP: Found a face centered cubic cell.
 ALAT       =     3.5263137898
  
  Lattice vectors:
  
 A1 = (   0.0000000000,   1.7631568949,   1.7631568949)
 A2 = (   1.7631568949,   0.0000000000,   1.7631568949)
 A3 = (   1.7631568949,   1.7631568949,   0.0000000000)


Analysis of symmetry for initial positions (statically):
=====================================================================
 Subroutine PRICEL returns:
 Original cell was already a primitive cell.
 

 Routine SETGRP: Setting up the symmetry group for a 
 face centered cubic supercell.


 Subroutine GETGRP returns: Found 48 space group operations
 (whereof 24 operations were pure point group operations)
 out of a pool of 48 trial point group operations.


The static configuration has the point symmetry T_d .
 The point group associated with its full space group is O_h .


Analysis of symmetry for dynamics (positions and initial velocities):
=====================================================================
 Subroutine PRICEL returns:
 Original cell was already a primitive cell.
 

 Routine SETGRP: Setting up the symmetry group for a 
 face centered cubic supercell.


 Subroutine GETGRP returns: Found 48 space group operations
 (whereof 24 operations were pure point group operations)
 out of a pool of 48 trial point group operations.


The dynamic configuration has the point symmetry T_d .
 The point group associated with its full space group is O_h .


Analysis of constrained symmetry for selective dynamics:
=====================================================================
 Subroutine PRICEL returns:
 Original cell was already a primitive cell.
 

 Routine SETGRP: Setting up the symmetry group for a 
 face centered cubic supercell.


 Subroutine GETGRP returns: Found 48 space group operations
 (whereof 24 operations were pure point group operations)
 out of a pool of 48 trial point group operations.


The constrained configuration has the point symmetry T_d .
 The point group associated with its full space group is O_h .


 HEAD OF MICROSCOPIC STATIC DIELECTRIC TENSOR (INDEPENDENT PARTICLE, excluding Hartree and local field effects)
 ------------------------------------------------------
           5.928601     0.000000     0.000000
           0.000000     5.928601     0.000000
           0.000000     0.000000     5.928601
 ------------------------------------------------------



--------------------------------------------------------------------------------------------------------


 Linear response to external field, progress :
  Direction:   1
  LATTYP: Found a face centered cubic cell.
 ALAT       =     3.5263137898
  
  Lattice vectors:
  
 A1 = (   0.0000000000,   1.7631568949,   1.7631568949)
 A2 = (   1.7631568949,   0.0000000000,   1.7631568949)
 A3 = (   1.7631568949,   1.7631568949,   0.0000000000)


Analysis of symmetry for initial positions (statically):
=====================================================================
 Subroutine PRICEL returns:
 Original cell was already a primitive cell.
 

 Routine SETGRP: Setting up the symmetry group for a 
 face centered cubic supercell.


 Subroutine GETGRP returns: Found 48 space group operations
 (whereof 24 operations were pure point group operations)
 out of a pool of 48 trial point group operations.


The static configuration has the point symmetry T_d .
 The point group associated with its full space group is O_h .


Analysis of symmetry for dynamics (positions and initial velocities):
=====================================================================
 Subroutine PRICEL returns:
 Original cell was already a primitive cell.
 

 Routine SETGRP: Setting up the symmetry group for a 
 face centered cubic supercell.


 Subroutine GETGRP returns: Found  8 space group operations
 (whereof  4 operations were pure point group operations)
 out of a pool of 48 trial point group operations.


The dynamic configuration has the point symmetry C_2v.
 The point group associated with its full space group is C_4v.


Analysis of constrained symmetry for selective dynamics:
=====================================================================
 Subroutine PRICEL returns:
 Original cell was already a primitive cell.
 

 Routine SETGRP: Setting up the symmetry group for a 
 face centered cubic supercell.


 Subroutine GETGRP returns: Found  8 space group operations
 (whereof  4 operations were pure point group operations)
 out of a pool of 48 trial point group operations.


The constrained configuration has the point symmetry C_2v.
 The point group associated with its full space group is C_4v.


----------------------------------------- Iteration    1(   1)  ---------------------------------------


   POT+DIJ:  cpu time    0.0040: real time    0.0034
    HAMIL1:  cpu time    0.0460: real time    0.0473
    LRDIAG:  cpu time    0.0720: real time    0.0718
    LRDIIS:  cpu time    0.2030: real time    0.2031
    LRDIAG:  cpu time    0.0720: real time    0.0718
    --------------------------------------------
      LOOP:  cpu time    0.3969: real time    0.3979

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  -Hartree energ DENC   =         0.00000000
  -V(xc)+E(xc)   XCENC  =         0.00000000
  PAW double counting   =         0.00000000        0.00000000
  entropy T*S    EENTRO =         0.00000000
  eigenvalues    EBANDS =        -0.14613780
  ---------------------------------------------------
  free energy    TOTEN  =        -0.14613780 eV

  energy without entropy =       -0.14613780


----------------------------------------- Iteration    1(   2)  ---------------------------------------


   POT+DIJ:  cpu time    0.0030: real time    0.0025
    HAMIL1:  cpu time    0.0470: real time    0.0469
    LRDIAG:  cpu time    0.0710: real time    0.0717
    LRDIIS:  cpu time    0.1790: real time    0.1784
    LRDIAG:  cpu time    0.0710: real time    0.0713
    MIXING:  cpu time    0.0000: real time    0.0001
    --------------------------------------------
      LOOP:  cpu time    0.4019: real time    0.4097

 Broyden mixing:
  rms(total) = 0.68677E-01    rms(broyden)= 0.68616E-01
  rms(prec ) = 0.19416E+00
  weight for this iteration     100.00

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  -Hartree energ DENC   =         0.00000000
  -V(xc)+E(xc)   XCENC  =         0.00000000
  PAW double counting   =         0.00000000        0.00000000
  entropy T*S    EENTRO =         0.00000000
  eigenvalues    EBANDS =        -0.14928947
  ---------------------------------------------------
  free energy    TOTEN  =        -0.14928947 eV

  energy without entropy =       -0.14928947


----------------------------------------- Iteration    1(   3)  ---------------------------------------


   POT+DIJ:  cpu time    0.0030: real time    0.0024
    HAMIL1:  cpu time    0.0470: real time    0.0470
    LRDIAG:  cpu time    0.0720: real time    0.0721
    LRDIIS:  cpu time    0.1950: real time    0.1950
    LRDIAG:  cpu time    0.0710: real time    0.0714
    MIXING:  cpu time    0.0000: real time    0.0002
    --------------------------------------------
      LOOP:  cpu time    0.4199: real time    0.4248

 Broyden mixing:
  rms(total) = 0.39999E-01    rms(broyden)= 0.39995E-01
  rms(prec ) = 0.11086E+00
  weight for this iteration     100.00

 eigenvalues of (default mixing * dielectric matrix)
  average eigenvalue GAMMA=   2.3780
  2.3780

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  -Hartree energ DENC   =        -0.00235014
  -V(xc)+E(xc)   XCENC  =         0.00001117
  PAW double counting   =         0.00342399       -0.00339614
  entropy T*S    EENTRO =         0.00000000
  eigenvalues    EBANDS =        -0.14474068
  ---------------------------------------------------
  free energy    TOTEN  =        -0.14705180 eV

  energy without entropy =       -0.14705180


----------------------------------------- Iteration    1(   4)  ---------------------------------------


   POT+DIJ:  cpu time    0.0030: real time    0.0025
    HAMIL1:  cpu time    0.0460: real time    0.0465
    LRDIAG:  cpu time    0.0720: real time    0.0722
    LRDIIS:  cpu time    0.1930: real time    0.1926
    LRDIAG:  cpu time    0.0710: real time    0.0713
    MIXING:  cpu time    0.0010: real time    0.0003
    --------------------------------------------
      LOOP:  cpu time    0.4179: real time    0.4225

 Broyden mixing:
  rms(total) = 0.32680E-02    rms(broyden)= 0.32677E-02
  rms(prec ) = 0.96282E-02
  weight for this iteration     100.00

 eigenvalues of (default mixing * dielectric matrix)
  average eigenvalue GAMMA=   2.2042
  2.0102  2.3982

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  -Hartree energ DENC   =        -0.01256777
  -V(xc)+E(xc)   XCENC  =         0.00006086
  PAW double counting   =         0.01883275       -0.01866669
  entropy T*S    EENTRO =         0.00000000
  eigenvalues    EBANDS =        -0.13945061
  ---------------------------------------------------
  free energy    TOTEN  =        -0.15179146 eV

  energy without entropy =       -0.15179146


----------------------------------------- Iteration    1(   5)  ---------------------------------------


   POT+DIJ:  cpu time    0.0020: real time    0.0025
    HAMIL1:  cpu time    0.0470: real time    0.0467
    LRDIAG:  cpu time    0.0720: real time    0.0720
    LRDIIS:  cpu time    0.1980: real time    0.1985
    LRDIAG:  cpu time    0.0720: real time    0.0715
    MIXING:  cpu time    0.0000: real time    0.0003
    --------------------------------------------
      LOOP:  cpu time    0.4219: real time    0.4288

 Broyden mixing:
  rms(total) = 0.28697E-03    rms(broyden)= 0.28691E-03
  rms(prec ) = 0.55339E-03
  weight for this iteration     100.00

 eigenvalues of (default mixing * dielectric matrix)
  average eigenvalue GAMMA=   2.2653
  2.5147  2.3367  1.9446

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  -Hartree energ DENC   =        -0.01296144
  -V(xc)+E(xc)   XCENC  =         0.00006410
  PAW double counting   =         0.01996860       -0.01978029
  entropy T*S    EENTRO =         0.00000000
  eigenvalues    EBANDS =        -0.13948072
  ---------------------------------------------------
  free energy    TOTEN  =        -0.15218976 eV

  energy without entropy =       -0.15218976


----------------------------------------- Iteration    1(   6)  ---------------------------------------


   POT+DIJ:  cpu time    0.0030: real time    0.0025
    HAMIL1:  cpu time    0.0470: real time    0.0468
    LRDIAG:  cpu time    0.0720: real time    0.0718
    LRDIIS:  cpu time    0.1990: real time    0.1992
    LRDIAG:  cpu time    0.0710: real time    0.0715
    MIXING:  cpu time    0.0000: real time    0.0003
    --------------------------------------------
      LOOP:  cpu time    0.4229: real time    0.4290

 Broyden mixing:
  rms(total) = 0.16241E-03    rms(broyden)= 0.16241E-03
  rms(prec ) = 0.31039E-03
  weight for this iteration     100.00

 eigenvalues of (default mixing * dielectric matrix)
  average eigenvalue GAMMA=   2.0630
  2.6434  2.4367  1.9360  1.2358

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  -Hartree energ DENC   =        -0.01297102
  -V(xc)+E(xc)   XCENC  =         0.00006417
  PAW double counting   =         0.01995198       -0.01976381
  entropy T*S    EENTRO =         0.00000000
  eigenvalues    EBANDS =        -0.13948216
  ---------------------------------------------------
  free energy    TOTEN  =        -0.15220083 eV

  energy without entropy =       -0.15220083


----------------------------------------- Iteration    1(   7)  ---------------------------------------


   POT+DIJ:  cpu time    0.0020: real time    0.0025
    HAMIL1:  cpu time    0.0470: real time    0.0471
    LRDIAG:  cpu time    0.0720: real time    0.0720
    LRDIIS:  cpu time    0.1990: real time    0.1989
    LRDIAG:  cpu time    0.0720: real time    0.0715
    MIXING:  cpu time    0.0000: real time    0.0003
    --------------------------------------------
      LOOP:  cpu time    0.4239: real time    0.4293

 Broyden mixing:
  rms(total) = 0.60462E-05    rms(broyden)= 0.60400E-05
  rms(prec ) = 0.67261E-05
  weight for this iteration     100.00

 eigenvalues of (default mixing * dielectric matrix)
  average eigenvalue GAMMA=   2.0632
  0.9545  2.4994  2.4994  2.4089  1.9537

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  -Hartree energ DENC   =        -0.01297265
  -V(xc)+E(xc)   XCENC  =         0.00006420
  PAW double counting   =         0.01990094       -0.01971351
  entropy T*S    EENTRO =         0.00000000
  eigenvalues    EBANDS =        -0.13948422
  ---------------------------------------------------
  free energy    TOTEN  =        -0.15220524 eV

  energy without entropy =       -0.15220524


----------------------------------------- Iteration    1(   8)  ---------------------------------------


   POT+DIJ:  cpu time    0.0020: real time    0.0024
    HAMIL1:  cpu time    0.0470: real time    0.0467
    LRDIAG:  cpu time    0.0720: real time    0.0717
    LRDIIS:  cpu time    0.1970: real time    0.1976
    LRDIAG:  cpu time    0.0720: real time    0.0714
    MIXING:  cpu time    0.0010: real time    0.0004
    --------------------------------------------
      LOOP:  cpu time    0.4209: real time    0.4268

 Broyden mixing:
  rms(total) = 0.24412E-05    rms(broyden)= 0.24407E-05
  rms(prec ) = 0.30403E-05
  weight for this iteration     100.00

 eigenvalues of (default mixing * dielectric matrix)
  average eigenvalue GAMMA=   1.9220
  0.9744  1.0278  1.9414  2.6556  2.4182  2.5143

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  -Hartree energ DENC   =        -0.01297286
  -V(xc)+E(xc)   XCENC  =         0.00006420
  PAW double counting   =         0.01990221       -0.01971476
  entropy T*S    EENTRO =         0.00000000
  eigenvalues    EBANDS =        -0.13948417
  ---------------------------------------------------
  free energy    TOTEN  =        -0.15220538 eV

  energy without entropy =       -0.15220538


----------------------------------------- Iteration    1(   9)  ---------------------------------------


   POT+DIJ:  cpu time    0.0030: real time    0.0024
    HAMIL1:  cpu time    0.0470: real time    0.0469
    LRDIAG:  cpu time    0.0710: real time    0.0716
    LRDIIS:  cpu time    0.1980: real time    0.1975
    LRDIAG:  cpu time    0.0710: real time    0.0713
    MIXING:  cpu time    0.0000: real time    0.0003
    --------------------------------------------
      LOOP:  cpu time    0.4219: real time    0.4268

 Broyden mixing:
  rms(total) = 0.30143E-07    rms(broyden)= 0.28292E-07
  rms(prec ) = 0.63615E-07
  weight for this iteration     100.00

 eigenvalues of (default mixing * dielectric matrix)
  average eigenvalue GAMMA=   1.9163
  1.0010  0.9954  2.6432  2.4839  2.3878  1.9515  1.9515

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  -Hartree energ DENC   =        -0.01297279
  -V(xc)+E(xc)   XCENC  =         0.00006420
  PAW double counting   =         0.01990252       -0.01971506
  entropy T*S    EENTRO =         0.00000000
  eigenvalues    EBANDS =        -0.13948420
  ---------------------------------------------------
  free energy    TOTEN  =        -0.15220533 eV

  energy without entropy =       -0.15220533


------------------------ aborting loop because EDIFF is reached ----------------------------------------


 change of polarisation eV/A/(eV/A) component  1 :     0.288     0.009    -0.009
 dielectric tensor                  component  1 :     5.753     0.151    -0.153


--------------------------------------------------------------------------------------------------------


    FORLOC:  cpu time    0.0000: real time    0.0001
    FORNL :  cpu time    0.0110: real time    0.0109
    STRESS:  cpu time    0.2360: real time    0.2360
    FORCOR:  cpu time    0.0010: real time    0.0006
    OFIELD:  cpu time    0.0000: real time    0.0000
    FORLOC:  cpu time    0.0000: real time    0.0002
    FORNL :  cpu time    0.0110: real time    0.0109
    STRESS:  cpu time    0.2250: real time    0.2253
    FORCOR:  cpu time    0.0010: real time    0.0006
    OFIELD:  cpu time    0.0000: real time    0.0000
    FORNLD:  cpu time    0.0920: real time    0.0927

 PIEZOELECTRIC TENSOR FIELD DIRECTION 1  (e Angst)
 -----------------------------------------------------------------------------
     0.00020 -0.00000  0.00000           ( -0.00000  0.00000  0.00000)
     0.00000 -0.00015 -0.00000           (  0.00000 -0.00000  0.00000)
     0.00000  0.00000 -0.00015           (  0.00000  0.00000 -0.00000)

 PIEZOELECTRIC TENSOR FIELD DIRECTION 1  (C/m^2)
 -----------------------------------------------------------------------------
     0.00029 -0.00000  0.00000
     0.00000 -0.00022 -0.00000
     0.00000  0.00000 -0.00022


      POSITION         DIRECTION 1           BORN EFFECTIVE CHARGE    (rigid.aug.   ionic)
 -----------------------------------------------------------------------------------------
      0.00000      0.00000      0.00000     0.00125  0.00000  0.00000 ( -0.11283  4.00000)
      0.88158      0.88158      0.88158     0.00125 -0.00000 -0.00000 ( -0.11283  4.00000)
 -----------------------------------------------------------------------------------------
    total drift (improves with k-points):   0.00249  0.00000  0.00000




--------------------------------------------------------------------------------------------------------


 Linear response to external field, progress :
  Direction:   2
  LATTYP: Found a face centered cubic cell.
 ALAT       =     3.5263137898
  
  Lattice vectors:
  
 A1 = (   0.0000000000,   1.7631568949,   1.7631568949)
 A2 = (   1.7631568949,   0.0000000000,   1.7631568949)
 A3 = (   1.7631568949,   1.7631568949,   0.0000000000)


Analysis of symmetry for initial positions (statically):
=====================================================================
 Subroutine PRICEL returns:
 Original cell was already a primitive cell.
 

 Routine SETGRP: Setting up the symmetry group for a 
 face centered cubic supercell.


 Subroutine GETGRP returns: Found 48 space group operations
 (whereof 24 operations were pure point group operations)
 out of a pool of 48 trial point group operations.


The static configuration has the point symmetry T_d .
 The point group associated with its full space group is O_h .


Analysis of symmetry for dynamics (positions and initial velocities):
=====================================================================
 Subroutine PRICEL returns:
 Original cell was already a primitive cell.
 

 Routine SETGRP: Setting up the symmetry group for a 
 face centered cubic supercell.


 Subroutine GETGRP returns: Found  8 space group operations
 (whereof  4 operations were pure point group operations)
 out of a pool of 48 trial point group operations.


The dynamic configuration has the point symmetry C_2v.
 The point group associated with its full space group is C_4v.


Analysis of constrained symmetry for selective dynamics:
=====================================================================
 Subroutine PRICEL returns:
 Original cell was already a primitive cell.
 

 Routine SETGRP: Setting up the symmetry group for a 
 face centered cubic supercell.


 Subroutine GETGRP returns: Found  8 space group operations
 (whereof  4 operations were pure point group operations)
 out of a pool of 48 trial point group operations.


The constrained configuration has the point symmetry C_2v.
 The point group associated with its full space group is C_4v.


----------------------------------------- Iteration    2(   1)  ---------------------------------------


   POT+DIJ:  cpu time    0.0040: real time    0.0034
    HAMIL1:  cpu time    0.0470: real time    0.0473
    LRDIAG:  cpu time    0.0720: real time    0.0721
    LRDIIS:  cpu time    0.2030: real time    0.2031
    LRDIAG:  cpu time    0.0720: real time    0.0714
    --------------------------------------------
      LOOP:  cpu time    0.3979: real time    0.3980

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  -Hartree energ DENC   =         0.00000000
  -V(xc)+E(xc)   XCENC  =         0.00000000
  PAW double counting   =         0.00000000        0.00000000
  entropy T*S    EENTRO =         0.00000000
  eigenvalues    EBANDS =        -0.14613126
  ---------------------------------------------------
  free energy    TOTEN  =        -0.14613126 eV

  energy without entropy =       -0.14613126


----------------------------------------- Iteration    2(   2)  ---------------------------------------


   POT+DIJ:  cpu time    0.0020: real time    0.0025
    HAMIL1:  cpu time    0.0470: real time    0.0471
    LRDIAG:  cpu time    0.0720: real time    0.0719
    LRDIIS:  cpu time    0.1790: real time    0.1785
    LRDIAG:  cpu time    0.0740: real time    0.0743
    MIXING:  cpu time    0.0000: real time    0.0002
    --------------------------------------------
      LOOP:  cpu time    0.4049: real time    0.4125

 Broyden mixing:
  rms(total) = 0.68677E-01    rms(broyden)= 0.68616E-01
  rms(prec ) = 0.19416E+00
  weight for this iteration     100.00

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  -Hartree energ DENC   =         0.00000000
  -V(xc)+E(xc)   XCENC  =         0.00000000
  PAW double counting   =         0.00000000        0.00000000
  entropy T*S    EENTRO =         0.00000000
  eigenvalues    EBANDS =        -0.14928947
  ---------------------------------------------------
  free energy    TOTEN  =        -0.14928947 eV

  energy without entropy =       -0.14928947


----------------------------------------- Iteration    2(   3)  ---------------------------------------


   POT+DIJ:  cpu time    0.0020: real time    0.0025
    HAMIL1:  cpu time    0.0480: real time    0.0471
    LRDIAG:  cpu time    0.0710: real time    0.0718
    LRDIIS:  cpu time    0.1930: real time    0.1927
    LRDIAG:  cpu time    0.0720: real time    0.0716
    MIXING:  cpu time    0.0000: real time    0.0002
    --------------------------------------------
      LOOP:  cpu time    0.4169: real time    0.4225

 Broyden mixing:
  rms(total) = 0.39999E-01    rms(broyden)= 0.39995E-01
  rms(prec ) = 0.11086E+00
  weight for this iteration     100.00

 eigenvalues of (default mixing * dielectric matrix)
  average eigenvalue GAMMA=   2.3780
  2.3780

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  -Hartree energ DENC   =        -0.00235014
  -V(xc)+E(xc)   XCENC  =         0.00001117
  PAW double counting   =         0.00342399       -0.00339614
  entropy T*S    EENTRO =         0.00000000
  eigenvalues    EBANDS =        -0.14474068
  ---------------------------------------------------
  free energy    TOTEN  =        -0.14705180 eV

  energy without entropy =       -0.14705180


----------------------------------------- Iteration    2(   4)  ---------------------------------------


   POT+DIJ:  cpu time    0.0030: real time    0.0024
    HAMIL1:  cpu time    0.0470: real time    0.0472
    LRDIAG:  cpu time    0.0720: real time    0.0719
    LRDIIS:  cpu time    0.1900: real time    0.1902
    LRDIAG:  cpu time    0.0720: real time    0.0716
    MIXING:  cpu time    0.0000: real time    0.0003
    --------------------------------------------
      LOOP:  cpu time    0.4149: real time    0.4201

 Broyden mixing:
  rms(total) = 0.32680E-02    rms(broyden)= 0.32677E-02
  rms(prec ) = 0.96282E-02
  weight for this iteration     100.00

 eigenvalues of (default mixing * dielectric matrix)
  average eigenvalue GAMMA=   2.2042
  2.0102  2.3982

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  -Hartree energ DENC   =        -0.01256777
  -V(xc)+E(xc)   XCENC  =         0.00006086
  PAW double counting   =         0.01883275       -0.01866669
  entropy T*S    EENTRO =         0.00000000
  eigenvalues    EBANDS =        -0.13945061
  ---------------------------------------------------
  free energy    TOTEN  =        -0.15179146 eV

  energy without entropy =       -0.15179146


----------------------------------------- Iteration    2(   5)  ---------------------------------------


   POT+DIJ:  cpu time    0.0020: real time    0.0024
    HAMIL1:  cpu time    0.0470: real time    0.0469
    LRDIAG:  cpu time    0.0720: real time    0.0722
    LRDIIS:  cpu time    0.1970: real time    0.1963
    LRDIAG:  cpu time    0.0710: real time    0.0714
    MIXING:  cpu time    0.0000: real time    0.0003
    --------------------------------------------
      LOOP:  cpu time    0.4199: real time    0.4265

 Broyden mixing:
  rms(total) = 0.28697E-03    rms(broyden)= 0.28691E-03
  rms(prec ) = 0.55339E-03
  weight for this iteration     100.00

 eigenvalues of (default mixing * dielectric matrix)
  average eigenvalue GAMMA=   2.2653
  2.5147  2.3367  1.9446

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  -Hartree energ DENC   =        -0.01296144
  -V(xc)+E(xc)   XCENC  =         0.00006410
  PAW double counting   =         0.01996860       -0.01978029
  entropy T*S    EENTRO =         0.00000000
  eigenvalues    EBANDS =        -0.13948072
  ---------------------------------------------------
  free energy    TOTEN  =        -0.15218976 eV

  energy without entropy =       -0.15218976


----------------------------------------- Iteration    2(   6)  ---------------------------------------


   POT+DIJ:  cpu time    0.0020: real time    0.0025
    HAMIL1:  cpu time    0.0480: real time    0.0474
    LRDIAG:  cpu time    0.0720: real time    0.0725
    LRDIIS:  cpu time    0.1980: real time    0.1972
    LRDIAG:  cpu time    0.0710: real time    0.0714
    MIXING:  cpu time    0.0000: real time    0.0003
    --------------------------------------------
      LOOP:  cpu time    0.4219: real time    0.4279

 Broyden mixing:
  rms(total) = 0.16241E-03    rms(broyden)= 0.16241E-03
  rms(prec ) = 0.31039E-03
  weight for this iteration     100.00

 eigenvalues of (default mixing * dielectric matrix)
  average eigenvalue GAMMA=   2.0630
  2.6434  2.4367  1.9360  1.2358

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  -Hartree energ DENC   =        -0.01297102
  -V(xc)+E(xc)   XCENC  =         0.00006417
  PAW double counting   =         0.01995198       -0.01976381
  entropy T*S    EENTRO =         0.00000000
  eigenvalues    EBANDS =        -0.13948216
  ---------------------------------------------------
  free energy    TOTEN  =        -0.15220083 eV

  energy without entropy =       -0.15220083


----------------------------------------- Iteration    2(   7)  ---------------------------------------


   POT+DIJ:  cpu time    0.0030: real time    0.0025
    HAMIL1:  cpu time    0.0470: real time    0.0469
    LRDIAG:  cpu time    0.0720: real time    0.0719
    LRDIIS:  cpu time    0.1980: real time    0.1981
    LRDIAG:  cpu time    0.0710: real time    0.0715
    MIXING:  cpu time    0.0010: real time    0.0003
    --------------------------------------------
      LOOP:  cpu time    0.4239: real time    0.4283

 Broyden mixing:
  rms(total) = 0.60462E-05    rms(broyden)= 0.60400E-05
  rms(prec ) = 0.67261E-05
  weight for this iteration     100.00

 eigenvalues of (default mixing * dielectric matrix)
  average eigenvalue GAMMA=   2.0632
  0.9545  2.4994  2.4994  2.4090  1.9537

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  -Hartree energ DENC   =        -0.01297265
  -V(xc)+E(xc)   XCENC  =         0.00006420
  PAW double counting   =         0.01990094       -0.01971351
  entropy T*S    EENTRO =         0.00000000
  eigenvalues    EBANDS =        -0.13948422
  ---------------------------------------------------
  free energy    TOTEN  =        -0.15220524 eV

  energy without entropy =       -0.15220524


----------------------------------------- Iteration    2(   8)  ---------------------------------------


   POT+DIJ:  cpu time    0.0020: real time    0.0025
    HAMIL1:  cpu time    0.0470: real time    0.0473
    LRDIAG:  cpu time    0.0720: real time    0.0719
    LRDIIS:  cpu time    0.1970: real time    0.1971
    LRDIAG:  cpu time    0.0720: real time    0.0713
    MIXING:  cpu time    0.0000: real time    0.0003
    --------------------------------------------
      LOOP:  cpu time    0.4209: real time    0.4276

 Broyden mixing:
  rms(total) = 0.24412E-05    rms(broyden)= 0.24406E-05
  rms(prec ) = 0.30403E-05
  weight for this iteration     100.00

 eigenvalues of (default mixing * dielectric matrix)
  average eigenvalue GAMMA=   1.9220
  0.9744  1.0278  1.9414  2.6556  2.4182  2.5143

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  -Hartree energ DENC   =        -0.01297286
  -V(xc)+E(xc)   XCENC  =         0.00006420
  PAW double counting   =         0.01990222       -0.01971476
  entropy T*S    EENTRO =         0.00000000
  eigenvalues    EBANDS =        -0.13948417
  ---------------------------------------------------
  free energy    TOTEN  =        -0.15220538 eV

  energy without entropy =       -0.15220538


----------------------------------------- Iteration    2(   9)  ---------------------------------------


   POT+DIJ:  cpu time    0.0030: real time    0.0024
    HAMIL1:  cpu time    0.0470: real time    0.0471
    LRDIAG:  cpu time    0.0710: real time    0.0716
    LRDIIS:  cpu time    0.2040: real time    0.2034
    LRDIAG:  cpu time    0.0710: real time    0.0715
    MIXING:  cpu time    0.0010: real time    0.0004
    --------------------------------------------
      LOOP:  cpu time    0.4289: real time    0.4338

 Broyden mixing:
  rms(total) = 0.30146E-07    rms(broyden)= 0.28296E-07
  rms(prec ) = 0.63611E-07
  weight for this iteration     100.00

 eigenvalues of (default mixing * dielectric matrix)
  average eigenvalue GAMMA=   1.9164
  1.0010  0.9953  2.6432  2.4838  2.3877  1.9518  1.9518

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  -Hartree energ DENC   =        -0.01297279
  -V(xc)+E(xc)   XCENC  =         0.00006420
  PAW double counting   =         0.01990252       -0.01971506
  entropy T*S    EENTRO =         0.00000000
  eigenvalues    EBANDS =        -0.13948420
  ---------------------------------------------------
  free energy    TOTEN  =        -0.15220533 eV

  energy without entropy =       -0.15220533


------------------------ aborting loop because EDIFF is reached ----------------------------------------


 change of polarisation eV/A/(eV/A) component  2 :     0.009     0.288    -0.009
 dielectric tensor                  component  2 :     0.152     5.753    -0.154


--------------------------------------------------------------------------------------------------------


    FORLOC:  cpu time    0.0000: real time    0.0001
    FORNL :  cpu time    0.0100: real time    0.0103
    STRESS:  cpu time    0.2250: real time    0.2248
    FORCOR:  cpu time    0.0010: real time    0.0006
    OFIELD:  cpu time    0.0000: real time    0.0000
    FORLOC:  cpu time    0.0000: real time    0.0001
    FORNL :  cpu time    0.0100: real time    0.0103
    STRESS:  cpu time    0.2250: real time    0.2250
    FORCOR:  cpu time    0.0000: real time    0.0006
    OFIELD:  cpu time    0.0000: real time    0.0000
    FORNLD:  cpu time    0.0920: real time    0.0918

 PIEZOELECTRIC TENSOR FIELD DIRECTION 2  (e Angst)
 -----------------------------------------------------------------------------
    -0.00015  0.00000 -0.00000           ( -0.00000  0.00000  0.00000)
     0.00000  0.00020  0.00000           (  0.00000 -0.00000  0.00000)
    -0.00000  0.00000 -0.00015           (  0.00000  0.00000 -0.00000)

 PIEZOELECTRIC TENSOR FIELD DIRECTION 2  (C/m^2)
 -----------------------------------------------------------------------------
    -0.00022  0.00000 -0.00000
     0.00000  0.00029  0.00000
    -0.00000  0.00000 -0.00022


      POSITION         DIRECTION 2           BORN EFFECTIVE CHARGE    (rigid.aug.   ionic)
 -----------------------------------------------------------------------------------------
      0.00000      0.00000      0.00000     0.00000  0.00125  0.00000 ( -0.11283  4.00000)
      0.88158      0.88158      0.88158    -0.00000  0.00125 -0.00000 ( -0.11283  4.00000)
 -----------------------------------------------------------------------------------------
    total drift (improves with k-points):   0.00000  0.00249  0.00000




--------------------------------------------------------------------------------------------------------


 Linear response to external field, progress :
  Direction:   3
  LATTYP: Found a face centered cubic cell.
 ALAT       =     3.5263137898
  
  Lattice vectors:
  
 A1 = (   0.0000000000,   1.7631568949,   1.7631568949)
 A2 = (   1.7631568949,   0.0000000000,   1.7631568949)
 A3 = (   1.7631568949,   1.7631568949,   0.0000000000)


Analysis of symmetry for initial positions (statically):
=====================================================================
 Subroutine PRICEL returns:
 Original cell was already a primitive cell.
 

 Routine SETGRP: Setting up the symmetry group for a 
 face centered cubic supercell.


 Subroutine GETGRP returns: Found 48 space group operations
 (whereof 24 operations were pure point group operations)
 out of a pool of 48 trial point group operations.


The static configuration has the point symmetry T_d .
 The point group associated with its full space group is O_h .


Analysis of symmetry for dynamics (positions and initial velocities):
=====================================================================
 Subroutine PRICEL returns:
 Original cell was already a primitive cell.
 

 Routine SETGRP: Setting up the symmetry group for a 
 face centered cubic supercell.


 Subroutine GETGRP returns: Found  8 space group operations
 (whereof  4 operations were pure point group operations)
 out of a pool of 48 trial point group operations.


The dynamic configuration has the point symmetry C_2v.
 The point group associated with its full space group is C_4v.


Analysis of constrained symmetry for selective dynamics:
=====================================================================
 Subroutine PRICEL returns:
 Original cell was already a primitive cell.
 

 Routine SETGRP: Setting up the symmetry group for a 
 face centered cubic supercell.


 Subroutine GETGRP returns: Found  8 space group operations
 (whereof  4 operations were pure point group operations)
 out of a pool of 48 trial point group operations.


The constrained configuration has the point symmetry C_2v.
 The point group associated with its full space group is C_4v.


----------------------------------------- Iteration    3(   1)  ---------------------------------------


   POT+DIJ:  cpu time    0.0030: real time    0.0035
    HAMIL1:  cpu time    0.0480: real time    0.0481
    LRDIAG:  cpu time    0.0720: real time    0.0721
    LRDIIS:  cpu time    0.2000: real time    0.2000
    LRDIAG:  cpu time    0.0720: real time    0.0719
    --------------------------------------------
      LOOP:  cpu time    0.3969: real time    0.3962

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  -Hartree energ DENC   =         0.00000000
  -V(xc)+E(xc)   XCENC  =         0.00000000
  PAW double counting   =         0.00000000        0.00000000
  entropy T*S    EENTRO =         0.00000000
  eigenvalues    EBANDS =        -0.14613925
  ---------------------------------------------------
  free energy    TOTEN  =        -0.14613925 eV

  energy without entropy =       -0.14613925


----------------------------------------- Iteration    3(   2)  ---------------------------------------


   POT+DIJ:  cpu time    0.0030: real time    0.0025
    HAMIL1:  cpu time    0.0470: real time    0.0470
    LRDIAG:  cpu time    0.0720: real time    0.0722
    LRDIIS:  cpu time    0.1760: real time    0.1768
    LRDIAG:  cpu time    0.0720: real time    0.0718
    MIXING:  cpu time    0.0000: real time    0.0002
    --------------------------------------------
      LOOP:  cpu time    0.4019: real time    0.4092

 Broyden mixing:
  rms(total) = 0.68677E-01    rms(broyden)= 0.68616E-01
  rms(prec ) = 0.19416E+00
  weight for this iteration     100.00

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  -Hartree energ DENC   =         0.00000000
  -V(xc)+E(xc)   XCENC  =         0.00000000
  PAW double counting   =         0.00000000        0.00000000
  entropy T*S    EENTRO =         0.00000000
  eigenvalues    EBANDS =        -0.14928947
  ---------------------------------------------------
  free energy    TOTEN  =        -0.14928947 eV

  energy without entropy =       -0.14928947


----------------------------------------- Iteration    3(   3)  ---------------------------------------


   POT+DIJ:  cpu time    0.0030: real time    0.0025
    HAMIL1:  cpu time    0.0470: real time    0.0472
    LRDIAG:  cpu time    0.0720: real time    0.0720
    LRDIIS:  cpu time    0.1950: real time    0.1950
    LRDIAG:  cpu time    0.0720: real time    0.0715
    MIXING:  cpu time    0.0000: real time    0.0002
    --------------------------------------------
      LOOP:  cpu time    0.4209: real time    0.4255

 Broyden mixing:
  rms(total) = 0.39999E-01    rms(broyden)= 0.39995E-01
  rms(prec ) = 0.11086E+00
  weight for this iteration     100.00

 eigenvalues of (default mixing * dielectric matrix)
  average eigenvalue GAMMA=   2.3780
  2.3780

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  -Hartree energ DENC   =        -0.00235014
  -V(xc)+E(xc)   XCENC  =         0.00001117
  PAW double counting   =         0.00342399       -0.00339614
  entropy T*S    EENTRO =         0.00000000
  eigenvalues    EBANDS =        -0.14474068
  ---------------------------------------------------
  free energy    TOTEN  =        -0.14705180 eV

  energy without entropy =       -0.14705180


----------------------------------------- Iteration    3(   4)  ---------------------------------------


   POT+DIJ:  cpu time    0.0020: real time    0.0025
    HAMIL1:  cpu time    0.0470: real time    0.0470
    LRDIAG:  cpu time    0.0720: real time    0.0719
    LRDIIS:  cpu time    0.1950: real time    0.1950
    LRDIAG:  cpu time    0.0720: real time    0.0715
    MIXING:  cpu time    0.0000: real time    0.0002
    --------------------------------------------
      LOOP:  cpu time    0.4199: real time    0.4252

 Broyden mixing:
  rms(total) = 0.32680E-02    rms(broyden)= 0.32677E-02
  rms(prec ) = 0.96282E-02
  weight for this iteration     100.00

 eigenvalues of (default mixing * dielectric matrix)
  average eigenvalue GAMMA=   2.2042
  2.0102  2.3982

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  -Hartree energ DENC   =        -0.01256777
  -V(xc)+E(xc)   XCENC  =         0.00006086
  PAW double counting   =         0.01883275       -0.01866669
  entropy T*S    EENTRO =         0.00000000
  eigenvalues    EBANDS =        -0.13945061
  ---------------------------------------------------
  free energy    TOTEN  =        -0.15179146 eV

  energy without entropy =       -0.15179146


----------------------------------------- Iteration    3(   5)  ---------------------------------------


   POT+DIJ:  cpu time    0.0020: real time    0.0025
    HAMIL1:  cpu time    0.0480: real time    0.0474
    LRDIAG:  cpu time    0.0720: real time    0.0720
    LRDIIS:  cpu time    0.1990: real time    0.1996
    LRDIAG:  cpu time    0.0720: real time    0.0716
    MIXING:  cpu time    0.0000: real time    0.0003
    --------------------------------------------
      LOOP:  cpu time    0.4239: real time    0.4303

 Broyden mixing:
  rms(total) = 0.28697E-03    rms(broyden)= 0.28691E-03
  rms(prec ) = 0.55339E-03
  weight for this iteration     100.00

 eigenvalues of (default mixing * dielectric matrix)
  average eigenvalue GAMMA=   2.2653
  2.5147  2.3367  1.9446

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  -Hartree energ DENC   =        -0.01296144
  -V(xc)+E(xc)   XCENC  =         0.00006410
  PAW double counting   =         0.01996860       -0.01978029
  entropy T*S    EENTRO =         0.00000000
  eigenvalues    EBANDS =        -0.13948072
  ---------------------------------------------------
  free energy    TOTEN  =        -0.15218976 eV

  energy without entropy =       -0.15218976


----------------------------------------- Iteration    3(   6)  ---------------------------------------


   POT+DIJ:  cpu time    0.0030: real time    0.0025
    HAMIL1:  cpu time    0.0470: real time    0.0470
    LRDIAG:  cpu time    0.0720: real time    0.0720
    LRDIIS:  cpu time    0.2000: real time    0.2000
    LRDIAG:  cpu time    0.0710: real time    0.0715
    MIXING:  cpu time    0.0010: real time    0.0003
    --------------------------------------------
      LOOP:  cpu time    0.4259: real time    0.4304

 Broyden mixing:
  rms(total) = 0.16241E-03    rms(broyden)= 0.16241E-03
  rms(prec ) = 0.31039E-03
  weight for this iteration     100.00

 eigenvalues of (default mixing * dielectric matrix)
  average eigenvalue GAMMA=   2.0630
  2.6434  2.4367  1.9360  1.2358

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  -Hartree energ DENC   =        -0.01297102
  -V(xc)+E(xc)   XCENC  =         0.00006417
  PAW double counting   =         0.01995198       -0.01976381
  entropy T*S    EENTRO =         0.00000000
  eigenvalues    EBANDS =        -0.13948216
  ---------------------------------------------------
  free energy    TOTEN  =        -0.15220083 eV

  energy without entropy =       -0.15220083


----------------------------------------- Iteration    3(   7)  ---------------------------------------


   POT+DIJ:  cpu time    0.0020: real time    0.0024
    HAMIL1:  cpu time    0.0650: real time    0.0650
    LRDIAG:  cpu time    0.0720: real time    0.0721
    LRDIIS:  cpu time    0.2000: real time    0.1998
    LRDIAG:  cpu time    0.0710: real time    0.0715
    MIXING:  cpu time    0.0010: real time    0.0003
    --------------------------------------------
      LOOP:  cpu time    0.4419: real time    0.4480

 Broyden mixing:
  rms(total) = 0.60462E-05    rms(broyden)= 0.60401E-05
  rms(prec ) = 0.67261E-05
  weight for this iteration     100.00

 eigenvalues of (default mixing * dielectric matrix)
  average eigenvalue GAMMA=   2.0631
  0.9545  2.4993  2.4993  2.4088  1.9537

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  -Hartree energ DENC   =        -0.01297265
  -V(xc)+E(xc)   XCENC  =         0.00006420
  PAW double counting   =         0.01990094       -0.01971351
  entropy T*S    EENTRO =         0.00000000
  eigenvalues    EBANDS =        -0.13948422
  ---------------------------------------------------
  free energy    TOTEN  =        -0.15220524 eV

  energy without entropy =       -0.15220524


----------------------------------------- Iteration    3(   8)  ---------------------------------------


   POT+DIJ:  cpu time    0.0020: real time    0.0024
    HAMIL1:  cpu time    0.0470: real time    0.0469
    LRDIAG:  cpu time    0.0720: real time    0.0719
    LRDIIS:  cpu time    0.1970: real time    0.1976
    LRDIAG:  cpu time    0.0720: real time    0.0713
    MIXING:  cpu time    0.0000: real time    0.0003
    --------------------------------------------
      LOOP:  cpu time    0.4209: real time    0.4276

 Broyden mixing:
  rms(total) = 0.24413E-05    rms(broyden)= 0.24407E-05
  rms(prec ) = 0.30404E-05
  weight for this iteration     100.00

 eigenvalues of (default mixing * dielectric matrix)
  average eigenvalue GAMMA=   1.9220
  0.9744  1.0278  1.9414  2.6556  2.4182  2.5143

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  -Hartree energ DENC   =        -0.01297286
  -V(xc)+E(xc)   XCENC  =         0.00006420
  PAW double counting   =         0.01990221       -0.01971476
  entropy T*S    EENTRO =         0.00000000
  eigenvalues    EBANDS =        -0.13948417
  ---------------------------------------------------
  free energy    TOTEN  =        -0.15220538 eV

  energy without entropy =       -0.15220538


----------------------------------------- Iteration    3(   9)  ---------------------------------------


   POT+DIJ:  cpu time    0.0030: real time    0.0025
    HAMIL1:  cpu time    0.0470: real time    0.0470
    LRDIAG:  cpu time    0.0710: real time    0.0718
    LRDIIS:  cpu time    0.1980: real time    0.1977
    LRDIAG:  cpu time    0.0720: real time    0.0714
    MIXING:  cpu time    0.0000: real time    0.0003
    --------------------------------------------
      LOOP:  cpu time    0.4219: real time    0.4280

 Broyden mixing:
  rms(total) = 0.30146E-07    rms(broyden)= 0.28296E-07
  rms(prec ) = 0.63612E-07
  weight for this iteration     100.00

 eigenvalues of (default mixing * dielectric matrix)
  average eigenvalue GAMMA=   1.9164
  1.0010  0.9954  2.6432  2.4838  2.3877  1.9517  1.9517

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  -Hartree energ DENC   =        -0.01297279
  -V(xc)+E(xc)   XCENC  =         0.00006420
  PAW double counting   =         0.01990252       -0.01971506
  entropy T*S    EENTRO =         0.00000000
  eigenvalues    EBANDS =        -0.13948420
  ---------------------------------------------------
  free energy    TOTEN  =        -0.15220533 eV

  energy without entropy =       -0.15220533


------------------------ aborting loop because EDIFF is reached ----------------------------------------


 change of polarisation eV/A/(eV/A) component  3 :     0.019    -0.019     0.288
 dielectric tensor                  component  3 :     0.318    -0.320     5.753


--------------------------------------------------------------------------------------------------------


    FORLOC:  cpu time    0.0000: real time    0.0003
    FORNL :  cpu time    0.0110: real time    0.0103
    STRESS:  cpu time    0.2250: real time    0.2250
    FORCOR:  cpu time    0.0000: real time    0.0006
    OFIELD:  cpu time    0.0000: real time    0.0000
    FORLOC:  cpu time    0.0000: real time    0.0002
    FORNL :  cpu time    0.0110: real time    0.0104
    STRESS:  cpu time    0.2250: real time    0.2251
    FORCOR:  cpu time    0.0000: real time    0.0006
    OFIELD:  cpu time    0.0000: real time    0.0000
    FORNLD:  cpu time    0.0920: real time    0.0913

 PIEZOELECTRIC TENSOR FIELD DIRECTION 3  (e Angst)
 -----------------------------------------------------------------------------
    -0.00015  0.00000  0.00000           ( -0.00000  0.00000  0.00000)
     0.00000 -0.00015  0.00000           (  0.00000 -0.00000  0.00000)
     0.00000  0.00000  0.00020           (  0.00000  0.00000 -0.00000)

 PIEZOELECTRIC TENSOR FIELD DIRECTION 3  (C/m^2)
 -----------------------------------------------------------------------------
    -0.00022  0.00000  0.00000
     0.00000 -0.00022  0.00000
     0.00000  0.00000  0.00029


      POSITION         DIRECTION 3           BORN EFFECTIVE CHARGE    (rigid.aug.   ionic)
 -----------------------------------------------------------------------------------------
      0.00000      0.00000      0.00000    -0.00000 -0.00000  0.00125 ( -0.11283  4.00000)
      0.88158      0.88158      0.88158     0.00000  0.00000  0.00125 ( -0.11283  4.00000)
 -----------------------------------------------------------------------------------------
    total drift (improves with k-points):   0.00000  0.00000  0.00249




--------------------------------------------------------------------------------------------------------


  LATTYP: Found a face centered cubic cell.
 ALAT       =     3.5263137898
  
  Lattice vectors:
  
 A1 = (   0.0000000000,   1.7631568949,   1.7631568949)
 A2 = (   1.7631568949,   0.0000000000,   1.7631568949)
 A3 = (   1.7631568949,   1.7631568949,   0.0000000000)


Analysis of symmetry for initial positions (statically):
=====================================================================
 Subroutine PRICEL returns:
 Original cell was already a primitive cell.
 

 Routine SETGRP: Setting up the symmetry group for a 
 face centered cubic supercell.


 Subroutine GETGRP returns: Found 48 space group operations
 (whereof 24 operations were pure point group operations)
 out of a pool of 48 trial point group operations.


The static configuration has the point symmetry T_d .
 The point group associated with its full space group is O_h .


Analysis of symmetry for dynamics (positions and initial velocities):
=====================================================================
 Subroutine PRICEL returns:
 Original cell was already a primitive cell.
 

 Routine SETGRP: Setting up the symmetry group for a 
 face centered cubic supercell.


 Subroutine GETGRP returns: Found 48 space group operations
 (whereof 24 operations were pure point group operations)
 out of a pool of 48 trial point group operations.


The dynamic configuration has the point symmetry T_d .
 The point group associated with its full space group is O_h .


Analysis of constrained symmetry for selective dynamics:
=====================================================================
 Subroutine PRICEL returns:
 Original cell was already a primitive cell.
 

 Routine SETGRP: Setting up the symmetry group for a 
 face centered cubic supercell.


 Subroutine GETGRP returns: Found 48 space group operations
 (whereof 24 operations were pure point group operations)
 out of a pool of 48 trial point group operations.


The constrained configuration has the point symmetry T_d .
 The point group associated with its full space group is O_h .


 MACROSCOPIC STATIC DIELECTRIC TENSOR (including local field effects in DFT)
 ------------------------------------------------------
           5.753464     0.000000    -0.000000
          -0.000000     5.753464     0.000000
           0.000000    -0.000000     5.753464
 ------------------------------------------------------



--------------------------------------------------------------------------------------------------------


 Linear response:
   Degrees of freedom DOF   =            1
 Linear response progress:
  Degree of freedom:   1/  1
  LATTYP: Found a face centered cubic cell.
 ALAT       =     3.5263137898
  
  Lattice vectors:
  
 A1 = (   0.0000000000,   1.7631568949,   1.7631568949)
 A2 = (   1.7631568949,   0.0000000000,   1.7631568949)
 A3 = (   1.7631568949,   1.7631568949,   0.0000000000)


Analysis of symmetry for initial positions (statically):
=====================================================================
 Subroutine PRICEL returns:
 Original cell was already a primitive cell.
 

 Routine SETGRP: Setting up the symmetry group for a 
 face centered cubic supercell.


 Subroutine GETGRP returns: Found 48 space group operations
 (whereof 24 operations were pure point group operations)
 out of a pool of 48 trial point group operations.


The static configuration has the point symmetry T_d .
 The point group associated with its full space group is O_h .


Analysis of symmetry for dynamics (positions and initial velocities):
=====================================================================
 Subroutine PRICEL returns:
 Original cell was already a primitive cell.
 

 Routine SETGRP: Setting up the symmetry group for a 
 face centered cubic supercell.


 Subroutine GETGRP returns: Found  4 space group operations
 (whereof  4 operations were pure point group operations)
 out of a pool of 48 trial point group operations.


The dynamic configuration has the point symmetry C_2v.


Analysis of constrained symmetry for selective dynamics:
=====================================================================
 Subroutine PRICEL returns:
 Original cell was already a primitive cell.
 

 Routine SETGRP: Setting up the symmetry group for a 
 face centered cubic supercell.


 Subroutine GETGRP returns: Found  4 space group operations
 (whereof  4 operations were pure point group operations)
 out of a pool of 48 trial point group operations.


The constrained configuration has the point symmetry C_2v.


----------------------------------------- Iteration    4(   1)  ---------------------------------------


   POT+DIJ:  cpu time    0.0070: real time    0.0070
    HAMIL1:  cpu time    0.0780: real time    0.0787
    LRDIAG:  cpu time    0.1440: real time    0.1437
    LRDIIS:  cpu time    0.3679: real time    0.3675
    LRDIAG:  cpu time    0.1440: real time    0.1440
    --------------------------------------------
      LOOP:  cpu time    0.7449: real time    0.7454

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  -Hartree energ DENC   =        -0.01232048
  -V(xc)+E(xc)   XCENC  =         0.00003450
  PAW double counting   =         0.00000000        0.00000000
  entropy T*S    EENTRO =         0.00000000
  eigenvalues    EBANDS =        -0.10754342
  ---------------------------------------------------
  free energy    TOTEN  =        -0.11982939 eV

  energy without entropy =       -0.11982939


----------------------------------------- Iteration    4(   2)  ---------------------------------------


   POT+DIJ:  cpu time    0.0060: real time    0.0062
    HAMIL1:  cpu time    0.0780: real time    0.0785
    LRDIAG:  cpu time    0.1440: real time    0.1439
    LRDIIS:  cpu time    0.3310: real time    0.3310
    LRDIAG:  cpu time    0.1440: real time    0.1441
    MIXING:  cpu time    0.0000: real time    0.0002
    --------------------------------------------
      LOOP:  cpu time    0.7649: real time    0.7734

 Broyden mixing:
  rms(total) = 0.94836E+00    rms(broyden)= 0.94770E+00
  rms(prec ) = 0.31392E+01
  weight for this iteration     100.00

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  -Hartree energ DENC   =        -0.01232048
  -V(xc)+E(xc)   XCENC  =         0.00003450
  PAW double counting   =         0.00000000        0.00000000
  entropy T*S    EENTRO =         0.00000000
  eigenvalues    EBANDS =        -0.09800734
  ---------------------------------------------------
  free energy    TOTEN  =        -0.11029332 eV

  energy without entropy =       -0.11029332


----------------------------------------- Iteration    4(   3)  ---------------------------------------


   POT+DIJ:  cpu time    0.0060: real time    0.0061
    HAMIL1:  cpu time    0.0780: real time    0.0786
    LRDIAG:  cpu time    0.1440: real time    0.1436
    LRDIIS:  cpu time    0.3899: real time    0.3903
    LRDIAG:  cpu time    0.1440: real time    0.1433
    MIXING:  cpu time    0.0000: real time    0.0002
    --------------------------------------------
      LOOP:  cpu time    0.8229: real time    0.8295

 Broyden mixing:
  rms(total) = 0.51668E+00    rms(broyden)= 0.51663E+00
  rms(prec ) = 0.16388E+01
  weight for this iteration     100.00

 eigenvalues of (default mixing * dielectric matrix)
  average eigenvalue GAMMA=   2.1650
  2.1650

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  -Hartree energ DENC   =        -0.01533719
  -V(xc)+E(xc)   XCENC  =         0.00004009
  PAW double counting   =         0.00089560       -0.00089436
  entropy T*S    EENTRO =         0.00000000
  eigenvalues    EBANDS =        -0.09519082
  ---------------------------------------------------
  free energy    TOTEN  =        -0.11048668 eV

  energy without entropy =       -0.11048668


----------------------------------------- Iteration    4(   4)  ---------------------------------------


   POT+DIJ:  cpu time    0.0060: real time    0.0061
    HAMIL1:  cpu time    0.0790: real time    0.0787
    LRDIAG:  cpu time    0.1430: real time    0.1437
    LRDIIS:  cpu time    0.3959: real time    0.3955
    LRDIAG:  cpu time    0.1430: real time    0.1431
    MIXING:  cpu time    0.0000: real time    0.0003
    --------------------------------------------
      LOOP:  cpu time    0.8299: real time    0.8361

 Broyden mixing:
  rms(total) = 0.66539E-01    rms(broyden)= 0.66514E-01
  rms(prec ) = 0.16720E+00
  weight for this iteration     100.00

 eigenvalues of (default mixing * dielectric matrix)
  average eigenvalue GAMMA=   2.2074
  1.9679  2.4468

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  -Hartree energ DENC   =        -0.01897770
  -V(xc)+E(xc)   XCENC  =         0.00004743
  PAW double counting   =         0.00438174       -0.00437642
  entropy T*S    EENTRO =         0.00000000
  eigenvalues    EBANDS =        -0.09236609
  ---------------------------------------------------
  free energy    TOTEN  =        -0.11129103 eV

  energy without entropy =       -0.11129103


----------------------------------------- Iteration    4(   5)  ---------------------------------------


   POT+DIJ:  cpu time    0.0070: real time    0.0061
    HAMIL1:  cpu time    0.0780: real time    0.0785
    LRDIAG:  cpu time    0.1440: real time    0.1442
    LRDIIS:  cpu time    0.3909: real time    0.3907
    LRDIAG:  cpu time    0.1430: real time    0.1432
    MIXING:  cpu time    0.0000: real time    0.0003
    --------------------------------------------
      LOOP:  cpu time    0.8259: real time    0.8307

 Broyden mixing:
  rms(total) = 0.40195E-02    rms(broyden)= 0.40041E-02
  rms(prec ) = 0.10390E-01
  weight for this iteration     100.00

 eigenvalues of (default mixing * dielectric matrix)
  average eigenvalue GAMMA=   2.0729
  2.5098  1.7186  1.9904

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  -Hartree energ DENC   =        -0.01888235
  -V(xc)+E(xc)   XCENC  =         0.00004719
  PAW double counting   =         0.00521190       -0.00520642
  entropy T*S    EENTRO =         0.00000000
  eigenvalues    EBANDS =        -0.09242709
  ---------------------------------------------------
  free energy    TOTEN  =        -0.11125679 eV

  energy without entropy =       -0.11125679


----------------------------------------- Iteration    4(   6)  ---------------------------------------


   POT+DIJ:  cpu time    0.0060: real time    0.0062
    HAMIL1:  cpu time    0.0790: real time    0.0785
    LRDIAG:  cpu time    0.1440: real time    0.1438
    LRDIIS:  cpu time    0.3919: real time    0.3928
    LRDIAG:  cpu time    0.1430: real time    0.1431
    MIXING:  cpu time    0.0000: real time    0.0003
    --------------------------------------------
      LOOP:  cpu time    0.8289: real time    0.8334

 Broyden mixing:
  rms(total) = 0.20239E-02    rms(broyden)= 0.20227E-02
  rms(prec ) = 0.48422E-02
  weight for this iteration     100.00

 eigenvalues of (default mixing * dielectric matrix)
  average eigenvalue GAMMA=   1.9390
  0.9843  2.5351  2.2565  1.9802

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  -Hartree energ DENC   =        -0.01887538
  -V(xc)+E(xc)   XCENC  =         0.00004717
  PAW double counting   =         0.00521981       -0.00521432
  entropy T*S    EENTRO =         0.00000000
  eigenvalues    EBANDS =        -0.09243138
  ---------------------------------------------------
  free energy    TOTEN  =        -0.11125410 eV

  energy without entropy =       -0.11125410


----------------------------------------- Iteration    4(   7)  ---------------------------------------


   POT+DIJ:  cpu time    0.0070: real time    0.0061
    HAMIL1:  cpu time    0.0780: real time    0.0786
    LRDIAG:  cpu time    0.1440: real time    0.1437
    LRDIIS:  cpu time    0.3919: real time    0.3918
    LRDIAG:  cpu time    0.1430: real time    0.1432
    MIXING:  cpu time    0.0010: real time    0.0003
    --------------------------------------------
      LOOP:  cpu time    0.8269: real time    0.8302

 Broyden mixing:
  rms(total) = 0.28953E-03    rms(broyden)= 0.28928E-03
  rms(prec ) = 0.60651E-03
  weight for this iteration     100.00

 eigenvalues of (default mixing * dielectric matrix)
  average eigenvalue GAMMA=   1.9888
  1.0184  2.6077  2.3986  1.9681  1.9512

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  -Hartree energ DENC   =        -0.01887236
  -V(xc)+E(xc)   XCENC  =         0.00004716
  PAW double counting   =         0.00520752       -0.00520202
  entropy T*S    EENTRO =         0.00000000
  eigenvalues    EBANDS =        -0.09243282
  ---------------------------------------------------
  free energy    TOTEN  =        -0.11125253 eV

  energy without entropy =       -0.11125253


----------------------------------------- Iteration    4(   8)  ---------------------------------------


   POT+DIJ:  cpu time    0.0060: real time    0.0061
    HAMIL1:  cpu time    0.0780: real time    0.0785
    LRDIAG:  cpu time    0.1440: real time    0.1440
    LRDIIS:  cpu time    0.3929: real time    0.3926
    LRDIAG:  cpu time    0.1430: real time    0.1433
    MIXING:  cpu time    0.0000: real time    0.0004
    --------------------------------------------
      LOOP:  cpu time    0.8259: real time    0.8312

 Broyden mixing:
  rms(total) = 0.12138E-04    rms(broyden)= 0.11885E-04
  rms(prec ) = 0.30553E-04
  weight for this iteration     100.00

 eigenvalues of (default mixing * dielectric matrix)
  average eigenvalue GAMMA=   1.8382
  2.5743  2.4294  2.0367  1.9438  1.0223  1.0223

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  -Hartree energ DENC   =        -0.01887209
  -V(xc)+E(xc)   XCENC  =         0.00004715
  PAW double counting   =         0.00520450       -0.00519899
  entropy T*S    EENTRO =         0.00000000
  eigenvalues    EBANDS =        -0.09243286
  ---------------------------------------------------
  free energy    TOTEN  =        -0.11125228 eV

  energy without entropy =       -0.11125228


----------------------------------------- Iteration    4(   9)  ---------------------------------------


   POT+DIJ:  cpu time    0.0060: real time    0.0061
    HAMIL1:  cpu time    0.0780: real time    0.0786
    LRDIAG:  cpu time    0.1440: real time    0.1437
    LRDIIS:  cpu time    0.3919: real time    0.3922
    LRDIAG:  cpu time    0.1430: real time    0.1432
    MIXING:  cpu time    0.0000: real time    0.0004
    --------------------------------------------
      LOOP:  cpu time    0.8249: real time    0.8314

 Broyden mixing:
  rms(total) = 0.56299E-05    rms(broyden)= 0.56075E-05
  rms(prec ) = 0.12898E-04
  weight for this iteration     100.00

 eigenvalues of (default mixing * dielectric matrix)
  average eigenvalue GAMMA=   1.9277
  1.0038  0.9937  1.9404  2.0221  2.4023  2.5319  2.5998

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  -Hartree energ DENC   =        -0.01887211
  -V(xc)+E(xc)   XCENC  =         0.00004715
  PAW double counting   =         0.00520441       -0.00519890
  entropy T*S    EENTRO =         0.00000000
  eigenvalues    EBANDS =        -0.09243284
  ---------------------------------------------------
  free energy    TOTEN  =        -0.11125229 eV

  energy without entropy =       -0.11125229

 k-point   1 :       0.0417    0.0417    0.0417
  band No.  band energies     occupation 
      1      -0.0015      0.00000
      2      -9.5571      0.00000
      3      -5.3122      0.00000
      4      15.3985     -0.00000
      5     -13.5754      0.00000
      6       4.8609      0.00000
      7       8.2895      0.00000
      8       0.0894      0.00000
      9      -0.1141      0.00000
     10      -3.2975      0.00000
     11       0.3505      0.00000
     12       5.9957      0.00000
     13      -6.0232      0.00000
     14       2.5914      0.00000
     15       0.2987      0.00000
     16      -9.8973      0.00000
     17      -5.1051      0.00000
     18      14.9392      0.00000
     19     -10.3127      0.00000
     20       0.8997      0.00000

 k-point   2 :       0.1250    0.0417    0.0417
  band No.  band energies     occupation 
      1      -0.0132      0.00000
      2      -8.8793      0.00000
      3      -3.2880      0.00000
      4      14.9917      0.00000
      5     -13.6373      0.00000
      6      12.8766      0.00000
      7      -1.1364      0.00000
      8       0.7717      0.00000
      9      -0.9608      0.00000
     10      -3.0731      0.00000
     11      -0.3985      0.00000
     12       2.7013      0.00000
     13       3.5941      0.00000
     14      -5.8303      0.00000
     15       2.2038      0.00000
     16     -12.2099      0.00000
     17      -2.4450      0.00000
     18      14.1359      0.00000
     19      -5.0312      0.00000
     20      -6.5952      0.00000

 k-point   3 :       0.2083    0.0417    0.0417
  band No.  band energies     occupation 
      1      -0.0320      0.00000
      2      -5.1225      0.00000
      3      -4.9390      0.00000
      4      12.9467      0.00000
      5     -12.5914      0.00000
      6      13.1661      0.00000
      7      -1.0175      0.00000
      8       1.9395      0.00000
      9      -2.5578      0.00000
     10      -1.8205      0.00000
     11      -5.1618      0.00000
     12       4.6756      0.00000
     13       2.3994      0.00000
     14      -6.2382      0.00000
     15       3.6648      0.00000
     16     -10.2999      0.00000
     17      -3.2616      0.00000
     18      11.4684      0.00000
     19      -1.7943      0.00000
     20       0.2680      0.00000

 k-point   4 :       0.2917    0.0417    0.0417
  band No.  band energies     occupation 
      1      -0.0427      0.00000
      2      -3.5276      0.00000
      3      -5.6417      0.00000
      4      11.3555      0.00000
      5     -12.2947      0.00000
      6      13.4285      0.00000
      7       0.7524      0.00000
      8       3.3404      0.00000
      9      -4.6682      0.00000
     10      -0.1771      0.00000
     11      -9.8007      0.00000
     12       5.7466      0.00000
     13       1.0937      0.00000
     14      -7.3402      0.00000
     15      -5.3149      0.00000
     16       7.9354      0.00000
     17      -7.5666      0.00000
     18       6.8148      0.00000
     19       0.2645      0.00000
     20       6.4011      0.00000

 k-point   5 :       0.3750    0.0417    0.0417
  band No.  band energies     occupation 
      1       0.0109      0.00000
      2      -2.7466      0.00000
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      4      10.3583      0.00000
      5     -12.3225      0.00000
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      7       2.2176      0.00000
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     10       1.3705      0.00000
     11     -11.1258      0.00000
     12       3.9383      0.00000
     13      -4.4831      0.00000
     14       3.0988      0.00000
     15      -6.7314      0.00000
     16       2.9596      0.00000
     17      -6.7321      0.00000
     18       7.2071      0.00000
     19      10.4540      0.00000
     20       2.1600      0.00000

 k-point   6 :       0.4583    0.0417    0.0417
  band No.  band energies     occupation 
      1       0.4160      0.00000
      2      -2.7306      0.00000
      3      -6.5952      0.00000
      4       9.7434      0.00000
      5     -12.1779      0.00000
      6      14.3076      0.00000
      7       2.0907      0.00000
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      9      -9.4668      0.00000
     10       2.6986      0.00000
     11       3.3949      0.00000
     12     -12.3222      0.00000
     13      -2.4692      0.00000
     14       1.1104      0.00000
     15      -7.8229      0.00000
     16       6.5711      0.00000
     17      -9.1469      0.00000
     18       6.1536      0.00000
     19       8.5701      0.00000
     20       2.7486      0.00000

 k-point   7 :      -0.4583    0.0417    0.0417
  band No.  band energies     occupation 
      1       1.4794      0.00000
      2      -3.6574      0.00000
      3      -6.8224      0.00000
      4       9.3748      0.00000
      5      14.3014      0.00000
      6     -11.8265      0.00000
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      8       5.5538      0.00000
      9     -10.3930      0.00000
     10       8.0617      0.00000
     11     -15.4016      0.00000
     12       3.5156      0.00000
     13      -0.0283      0.00000
     14      -3.1782      0.00000
     15      -6.5394      0.00000
     16     -10.8191      0.00000
     17      10.4769      0.00000
     18       3.1420      0.00000
     19      -5.1911      0.00000
     20       7.0584      0.00000

 k-point   8 :      -0.3750    0.0417    0.0417
  band No.  band energies     occupation 
      1       0.1918      0.00000
      2      -2.4766      0.00000
      3       9.2105      0.00000
      4      -6.8436      0.00000
      5      13.2565      0.00000
      6     -11.3011      0.00000
      7       2.5781      0.00000
      8       4.3530      0.00000
      9      -7.2644      0.00000
     10      -4.2432      0.00000
     11      -1.7372      0.00000
     12       2.2591      0.00000
     13       1.2549      0.00000
     14      -5.8803      0.00000
     15      -6.4382      0.00000
     16      -7.5883      0.00000
     17       8.4323      0.00000
     18       5.8678      0.00000
     19      -2.0762      0.00000
     20      16.0037      0.00000

 k-point   9 :      -0.2917    0.0417    0.0417
  band No.  band energies     occupation 
      1      -0.0090      0.00000
      2      -2.6504      0.00000
      3       9.3107      0.00000
      4      -6.6777      0.00000
      5      10.7214      0.00000
      6     -10.6027      0.00000
      7       3.7471      0.00000
      8       2.7916      0.00000
      9      -4.4842      0.00000
     10      -5.9075      0.00000
     11       0.5226      0.00000
     12       2.0950      0.00000
     13       3.0748      0.00000
     14      -7.4788      0.00000
     15      -5.8198      0.00000
     16      -0.8201      0.00000
     17       0.8286      0.00000
     18       3.8197      0.00000
     19      13.5135      0.00000
     20      -0.1558      0.00000

 k-point  10 :      -0.2083    0.0417    0.0417
  band No.  band energies     occupation 
      1      -0.0257      0.00000
      2      -3.3898      0.00000
      3       9.8234      0.00000
      4      -6.3030      0.00000
      5       6.9018      0.00000
      6      -9.9451      0.00000
      7       5.3396      0.00000
      8       1.6526      0.00000
      9      -4.0449      0.00000
     10      -2.1417      0.00000
     11      -1.1800      0.00000
     12       3.0428      0.00000
     13      -6.4983      0.00000
     14       5.8483      0.00000
     15       7.6788      0.00000
     16     -11.7138      0.00000
     17       5.3358      0.00000
     18      -6.1227      0.00000
     19       8.7621      0.00000
     20      -0.6314      0.00000

 k-point  11 :      -0.1250    0.0417    0.0417
  band No.  band energies     occupation 
      1      -0.0123      0.00000
      2      -4.8906      0.00000
      3      11.0185      0.00000
      4      -5.7854      0.00000
      5       3.3338      0.00000
      6      -9.9950      0.00000
      7       7.2756      0.00000
      8       0.7382      0.00000
      9      -1.5425      0.00000
     10      -0.9242      0.00000
     11      -2.6154      0.00000
     12       4.5633      0.00000
     13      -5.9631      0.00000
     14       4.3831      0.00000
     15       0.1266      0.00000
     16      -8.1020      0.00000
     17      11.4502      0.00000
     18      -5.3135      0.00000
     19       3.0197      0.00000
     20      -1.2014      0.00000

 k-point  12 :      -0.0417    0.0417    0.0417
  band No.  band energies     occupation 
      1      -0.0015      0.00000
      2      -8.3506      0.00000
      3      13.1613      0.00000
      4      -4.6142      0.00000
      5       0.7474      0.00000
      6     -11.4599      0.00000
      7      10.6253      0.00000
      8       0.0884      0.00000
      9      -0.1311      0.00000
     10      -0.1554      0.00000
     11      -3.0425      0.00000
     12       7.6292      0.00000
     13      -6.1633      0.00000
     14       1.5315      0.00000
     15       0.1266      0.00000
     16     -12.4914      0.00000
     17      14.1034      0.00000
     18      -1.7534      0.00000
     19      -3.7134      0.00000
     20       2.8007      0.00000

 k-point  13 :       0.1250    0.1250    0.0417
  band No.  band energies     occupation 
      1      -0.0071      0.00000
      2      -7.0118      0.00000
      3      -0.3701      0.00000
      4       8.6395      0.00000
      5      -1.9926      0.00000
      6       0.9412      0.00000
      7       0.2955      0.00000
      8       0.4160      0.00000
      9      -0.5218      0.00000
     10      -0.6563      0.00000
     11      -2.7459      0.00000
     12       2.7565      0.00000
     13       2.1421      0.00000
     14      -2.7362      0.00000
     15       0.8028      0.00000
     16      -5.3402      0.00000
     17      -0.4790      0.00000
     18       5.4913      0.00000
     19      -1.8174      0.00000
     20      -5.2179      0.00000

 k-point  14 :       0.2083    0.1250    0.0417
  band No.  band energies     occupation 
      1      -0.0269      0.00000
      2      -7.6631      0.00000
      3      -2.0930      0.00000
      4      12.7441      0.00000
      5      -4.4707      0.00000
      6       2.5412      0.00000
      7       1.0015      0.00000
      8       1.1978      0.00000
      9      -0.9886      0.00000
     10      -2.0206      0.00000
     11      -4.3387      0.00000
     12       2.8460      0.00000
     13       3.2997      0.00000
     14      -4.6110      0.00000
     15       2.2384      0.00000
     16      -7.2261      0.00000
     17      -2.8702      0.00000
     18       8.9407      0.00000
     19       0.3216      0.00000
     20      -5.1455      0.00000

 k-point  15 :       0.2917    0.1250    0.0417
  band No.  band energies     occupation 
      1      -0.0433      0.00000
      2      -4.5375      0.00000
      3      -3.9484      0.00000
      4      11.2745      0.00000
      5      -4.8024      0.00000
      6       0.9144      0.00000
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      8       1.5105      0.00000
      9      -0.1104      0.00000
     10      -3.9210      0.00000
     11      -6.6068      0.00000
     12       3.3715      0.00000
     13       1.7440      0.00000
     14      -5.3333      0.00000
     15      -4.0787      0.00000
     16      -4.9419      0.00000
     17       7.0735      0.00000
     18       3.6643      0.00000
     19       3.4676      0.00000
     20      -0.8490      0.00000

 k-point  16 :       0.3750    0.1250    0.0417
  band No.  band energies     occupation 
      1      -0.0180      0.00000
      2      -3.2382      0.00000
      3      -4.9087      0.00000
      4      10.1563      0.00000
      5      -4.1125      0.00000
      6       3.1312      0.00000
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      8       2.5008      0.00000
      9      -5.5351      0.00000
     10       0.7168      0.00000
     11      -6.5315      0.00000
     12       0.3147      0.00000
     13      -1.9178      0.00000
     14      -1.7483      0.00000
     15       3.2501      0.00000
     16      -4.5360      0.00000
     17      -2.5903      0.00000
     18       4.8257      0.00000
     19       6.6158      0.00000
     20       3.6644      0.00000

 k-point  17 :       0.4583    0.1250    0.0417
  band No.  band energies     occupation 
      1       0.2128      0.00000
      2      -2.7859      0.00000
      3      -5.2417      0.00000
      4       9.0515      0.00000
      5      -1.8904      0.00000
      6       3.1227      0.00000
      7       2.5871      0.00000
      8       4.6912      0.00000
      9      -8.5584      0.00000
     10       2.5840      0.00000
     11       0.5742      0.00000
     12      -9.3053      0.00000
     13      -1.1449      0.00000
     14       1.0627      0.00000
     15      -7.9496      0.00000
     16       5.2587      0.00000
     17      -6.9761      0.00000
     18       4.2480      0.00000
     19      10.7137      0.00000
     20       5.9014      0.00000

 k-point  18 :      -0.4583    0.1250    0.0417
  band No.  band energies     occupation 
      1       1.5284      0.00000
      2      -3.7932      0.00000
      3      -0.5573      0.00000
      4       3.3986      0.00000
      5       2.2123      0.00000
      6       0.2987      0.00000
      7       1.5869      0.00000
      8       5.8816      0.00000
      9     -10.0325      0.00000
     10       5.7117      0.00000
     11      -4.6276      0.00000
     12      -4.3320      0.00000
     13      -3.2597      0.00000
     14      -0.8501      0.00000
     15      -5.7515      0.00000
     16       6.8911      0.00000
     17     -10.4684      0.00000
     18       0.0334      0.00000
     19       4.8249      0.00000
     20      17.9712      0.00000

 k-point  19 :      -0.3750    0.1250    0.0417
  band No.  band energies     occupation 
      1       0.4231      0.00000
      2      -2.6520      0.00000
      3       2.9841      0.00000
      4      -0.6775      0.00000
      5      10.0849      0.00000
      6      -6.8907      0.00000
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      8       3.9539      0.00000
      9      -6.9598      0.00000
     10      -4.2521      0.00000
     11       2.1648      0.00000
     12       0.4402      0.00000
     13      -1.1799      0.00000
     14      -5.5047      0.00000
     15      -5.3687      0.00000
     16      -3.9685      0.00000
     17       8.2724      0.00000
     18       4.6197      0.00000
     19       8.3157      0.00000
     20       1.8283      0.00000

 k-point  20 :      -0.2917    0.1250    0.0417
  band No.  band energies     occupation 
      1       0.0322      0.00000
      2      -2.4757      0.00000
      3       4.0162      0.00000
      4      -1.7958      0.00000
      5      11.0329      0.00000
      6      -7.7786      0.00000
      7       0.3760      0.00000
      8       1.4804      0.00000
      9      -1.0707      0.00000
     10      -7.2088      0.00000
     11       3.7307      0.00000
     12      -0.7999      0.00000
     13       1.3220      0.00000
     14      -5.6255      0.00000
     15      -4.9359      0.00000
     16      -4.3994      0.00000
     17       5.8086      0.00000
     18       2.3430      0.00000
     19       6.7704      0.00000
     20       4.8238      0.00000

 k-point  21 :      -0.2083    0.1250    0.0417
  band No.  band energies     occupation 
      1      -0.0141      0.00000
      2      -2.9385      0.00000
      3       4.4932      0.00000
      4      -1.7931      0.00000
      5       5.2440      0.00000
      6      -3.1220      0.00000
      7       0.1022      0.00000
      8       0.5909      0.00000
      9       0.1333      0.00000
     10      -4.6224      0.00000
     11       1.7500      0.00000
     12      -0.0220      0.00000
     13      -1.7331      0.00000
     14       2.0673      0.00000
     15       0.2476      0.00000
     16      -3.6262      0.00000
     17      -3.5911      0.00000
     18       1.8661      0.00000
     19       8.3414      0.00000
     20      -0.6267      0.00000

 k-point  22 :      -0.1250    0.1250    0.0417
  band No.  band energies     occupation 
      1      -0.0060      0.00000
      2      -3.4690      0.00000
      3       4.3439      0.00000
      4      -0.9334      0.00000
      5       1.3879      0.00000
      6      -7.2545      0.00000
      7       6.4493      0.00000
      8       0.2477      0.00000
      9      -3.9094      0.00000
     10       2.7052      0.00000
     11       0.0318      0.00000
     12       1.4934      0.00000
     13      -1.9701      0.00000
     14       0.8811      0.00000
     15      -1.3690      0.00000
     16       2.9847      0.00000
     17      -1.8340      0.00000
     18      -1.4072      0.00000
     19       2.3027      0.00000
     20      -0.3628      0.00000

 k-point  23 :      -0.0417    0.1250    0.0417
  band No.  band energies     occupation 
      1       0.0042      0.00000
      2       5.1062      0.00000
      3      -7.0626      0.00000
      4       1.8892      0.00000
      5      -1.0968      0.00000
      6       3.9337      0.00000
      7      -3.0965      0.00000
      8      -0.2266      0.00000
      9       0.5652      0.00000
     10       0.1985      0.00000
     11       1.0378      0.00000
     12      -3.6470      0.00000
     13       3.8505      0.00000
     14      -1.3843      0.00000
     15       0.0244      0.00000
     16       0.3416      0.00000
     17      -1.9292      0.00000
     18       2.1155      0.00000
     19      -1.2203      0.00000
     20       0.4490      0.00000

 k-point  24 :       0.2083    0.2083    0.0417
  band No.  band energies     occupation 
      1      -0.0105      0.00000
      2      -6.2574      0.00000
      3      -0.3252      0.00000
      4       7.4800      0.00000
      5      -1.0236      0.00000
      6      -0.2858      0.00000
      7       1.2772      0.00000
      8       0.3205      0.00000
      9      -0.1306      0.00000
     10      -0.8072      0.00000
     11      -4.4681      0.00000
     12       2.9602      0.00000
     13       3.4643      0.00000
     14      -2.9996      0.00000
     15      -0.8176      0.00000
     16      -2.0171      0.00000
     17       0.4136      0.00000
     18       2.6168      0.00000
     19       1.2284      0.00000
     20      -3.9524      0.00000

 k-point  25 :       0.2917    0.2083    0.0417
  band No.  band energies     occupation 
      1      -0.0292      0.00000
      2      -7.2819      0.00000
      3      -1.5458      0.00000
      4      10.7874      0.00000
      5      -2.4872      0.00000
      6       3.6276      0.00000
      7       2.4263      0.00000
      8      -2.1981      0.00000
      9       0.6566      0.00000
     10      -2.6573      0.00000
     11      -7.2081      0.00000
     12       3.9979      0.00000
     13       3.4426      0.00000
     14      -4.7892      0.00000
     15      -2.1922      0.00000
     16      -2.7054      0.00000
     17       4.7796      0.00000
     18       1.2255      0.00000
     19       4.4365      0.00000
     20      -3.9854      0.00000

 k-point  26 :       0.3750    0.2083    0.0417
  band No.  band energies     occupation 
      1      -0.0185      0.00000
      2      -4.4464      0.00000
      3      -3.4269      0.00000
      4       9.6279      0.00000
      5      -2.7892      0.00000
      6      10.8794      0.00000
      7      -8.0489      0.00000
      8       3.3580      0.00000
      9       1.0693      0.00000
     10      -3.6716      0.00000
     11      -7.4989      0.00000
     12       1.2235      0.00000
     13       2.3159      0.00000
     14      -2.5983      0.00000
     15      -4.1836      0.00000
     16      -1.9677      0.00000
     17       3.8274      0.00000
     18       1.7320      0.00000
     19       7.5058      0.00000
     20       0.5215      0.00000

 k-point  27 :       0.4583    0.2083    0.0417
  band No.  band energies     occupation 
      1       0.1271      0.00000
      2      -3.3381      0.00000
      3      -1.5935      0.00000
      4       5.9532      0.00000
      5      -1.9334      0.00000
      6       5.8545      0.00000
      7      -2.3179      0.00000
      8       4.0735      0.00000
      9      -5.4806      0.00000
     10       2.2982      0.00000
     11      -5.8103      0.00000
     12      -2.4582      0.00000
     13      -0.8920      0.00000
     14      -5.2722      0.00000
     15       1.3337      0.00000
     16       5.1243      0.00000
     17      -5.7399      0.00000
     18      10.2203      0.00000
     19      -0.2717      0.00000
     20       6.8899      0.00000

 k-point  28 :      -0.4583    0.2083    0.0417
  band No.  band energies     occupation 
      1       0.9869      0.00000
      2      -3.5710      0.00000
      3       1.8004      0.00000
      4       1.3792      0.00000
      5      -0.5026      0.00000
      6       3.2342      0.00000
      7       0.8643      0.00000
      8       4.7140      0.00000
      9      -8.1055      0.00000
     10       4.0888      0.00000
     11      -8.2467      0.00000
     12       1.9629      0.00000
     13      -4.5977      0.00000
     14      -1.0314      0.00000
     15      -3.0719      0.00000
     16       5.5034      0.00000
     17      -8.0462      0.00000
     18      -7.2576      0.00000
     19      13.9574      0.00000
     20      12.9476      0.00000

 k-point  29 :      -0.3750    0.2083    0.0417
  band No.  band energies     occupation 
      1       0.8752      0.00000
      2      -3.2129      0.00000
      3       2.6907      0.00000
      4      -0.1939      0.00000
      5       0.9147      0.00000
      6       1.9655      0.00000
      7       0.5805      0.00000
      8       5.7322      0.00000
      9      -8.2878      0.00000
     10      -3.5623      0.00000
     11       1.3540      0.00000
     12       2.3228      0.00000
     13      -6.1088      0.00000
     14      -2.4406      0.00000
     15      -3.9874      0.00000
     16       0.9705      0.00000
     17       5.9642      0.00000
     18       7.0029      0.00000
     19      -4.5556      0.00000
     20       7.5909      0.00000

 k-point  30 :      -0.2917    0.2083    0.0417
  band No.  band energies     occupation 
      1       0.0972      0.00000
      2      -2.4553      0.00000
      3       2.8851      0.00000
      4      -0.6121      0.00000
      5       2.6675      0.00000
      6      -0.2145      0.00000
      7       0.1212      0.00000
      8       1.2906      0.00000
      9      -1.4977      0.00000
     10      -4.8564      0.00000
     11       2.6447      0.00000
     12       1.3408      0.00000
     13      -1.3517      0.00000
     14      -4.8022      0.00000
     15      -4.9854      0.00000
     16       1.5387      0.00000
     17       5.4748      0.00000
     18       2.0525      0.00000
     19       5.0550      0.00000
     20      -0.4136      0.00000

 k-point  31 :      -0.2083    0.2083    0.0417
  band No.  band energies     occupation 
      1       0.0019      0.00000
      2      -2.2528      0.00000
      3       2.5326      0.00000
      4      -0.3773      0.00000
      5       5.5015      0.00000
      6      -4.4769      0.00000
      7      -0.1418      0.00000
      8       0.1656      0.00000
      9       1.4050      0.00000
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     16      -2.3500      0.00000
     17       1.6095      0.00000
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     20       1.3798      0.00000

 k-point  32 :      -0.1250    0.2083    0.0417
  band No.  band energies     occupation 
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      3      -3.1380      0.00000
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     18      -0.8400      0.00000
     19      -2.9143      0.00000
     20       0.1370      0.00000

 k-point  33 :      -0.0417    0.2083    0.0417
  band No.  band energies     occupation 
      1       0.0171      0.00000
      2       3.6595      0.00000
      3      -6.7704      0.00000
      4       3.1867      0.00000
      5      -4.1052      0.00000
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      8      -0.8032      0.00000
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     10      -1.4522      0.00000
     11       0.4267      0.00000
     12      -1.9311      0.00000
     13       3.5489      0.00000
     14      -3.0652      0.00000
     15       4.9092      0.00000
     16      -8.8906      0.00000
     17       3.6707      0.00000
     18       4.2057      0.00000
     19      -6.3802      0.00000
     20       0.6943      0.00000

 k-point  34 :       0.2917    0.2917    0.0417
  band No.  band energies     occupation 
      1      -0.0079      0.00000
      2      -5.9727      0.00000
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      4       6.7349      0.00000
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      8      -0.7288      0.00000
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     10      -1.0307      0.00000
     11      -5.3519      0.00000
     12       3.4105      0.00000
     13       4.1376      0.00000
     14      -4.2503      0.00000
     15      -1.0885      0.00000
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     17       1.2969      0.00000
     18       1.9094      0.00000
     19       0.2463      0.00000
     20      -1.8179      0.00000

 k-point  35 :       0.3750    0.2917    0.0417
  band No.  band energies     occupation 
      1      -0.0030      0.00000
      2      -6.5617      0.00000
      3       0.4847      0.00000
      4       7.1461      0.00000
      5      -1.8481      0.00000
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      7       0.0253      0.00000
      8       1.8621      0.00000
      9       2.4255      0.00000
     10      -3.6025      0.00000
     11      -9.5792      0.00000
     12       3.2486      0.00000
     13       5.2471      0.00000
     14      -5.2136      0.00000
     15       1.4039      0.00000
     16      -3.1993      0.00000
     17       2.6172      0.00000
     18       5.8984      0.00000
     19      -0.0848      0.00000
     20     -10.4584      0.00000

 k-point  36 :       0.4583    0.2917    0.0417
  band No.  band energies     occupation 
      1       0.1004      0.00000
      2      -4.8282      0.00000
      3       3.0023      0.00000
      4       2.6058      0.00000
      5      -1.9205      0.00000
      6       2.8820      0.00000
      7       0.2859      0.00000
      8       2.3717      0.00000
      9      -2.0437      0.00000
     10       0.4549      0.00000
     11      -9.2849      0.00000
     12       1.6975      0.00000
     13      -0.2323      0.00000
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     15       3.5270      0.00000
     16       1.2902      0.00000
     17      -4.6521      0.00000
     18       9.0433      0.00000
     19      -4.0371      0.00000
     20      -8.6776      0.00000

 k-point  37 :      -0.4583    0.2917    0.0417
  band No.  band energies     occupation 
      1       0.6503      0.00000
      2      -4.1147      0.00000
      3       3.3127      0.00000
      4       0.6572      0.00000
      5      -0.9186      0.00000
      6       3.1448      0.00000
      7       0.1944      0.00000
      8       2.7538      0.00000
      9      -4.8223      0.00000
     10       2.7205      0.00000
     11      -7.0633      0.00000
     12       2.4469      0.00000
     13      -5.2707      0.00000
     14      -0.1077      0.00000
     15      -1.2894      0.00000
     16       5.4607      0.00000
     17       9.4617      0.00000
     18      -5.6577      0.00000
     19      -6.6519      0.00000
     20       3.6372      0.00000

 k-point  38 :      -0.3750    0.2917    0.0417
  band No.  band energies     occupation 
      1       1.5071      0.00000
      2      -4.2376      0.00000
      3       2.9114      0.00000
      4       0.0069      0.00000
      5      -0.1318      0.00000
      6       2.2548      0.00000
      7      -3.2152      0.00000
      8       8.0880      0.00000
      9      -6.5651      0.00000
     10       0.3182      0.00000
     11      -2.0292      0.00000
     12       2.3054      0.00000
     13      -5.9371      0.00000
     14      -1.2730      0.00000
     15      -4.0201      0.00000
     16       4.1253      0.00000
     17       9.7486      0.00000
     18       3.2991      0.00000
     19      -6.5099      0.00000
     20      -1.1984      0.00000

 k-point  39 :      -0.2917    0.2917    0.0417
  band No.  band energies     occupation 
      1       0.1207      0.00000
      2      -2.1475      0.00000
      3       2.1450      0.00000
      4      -0.1016      0.00000
      5       0.1561      0.00000
      6       0.6694      0.00000
      7      -1.0361      0.00000
      8       2.8601      0.00000
      9      -2.2605      0.00000
     10      -1.1649      0.00000
     11       0.6720      0.00000
     12       1.3499      0.00000
     13      -1.3832      0.00000
     14      -3.1025      0.00000
     15      -4.1250      0.00000
     16       4.8772      0.00000
     17       3.0780      0.00000
     18       0.1903      0.00000
     19      -0.0127      0.00000
     20      -1.3339      0.00000

 k-point  40 :      -0.2083    0.2917    0.0417
  band No.  band energies     occupation 
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      2       2.0790      0.00000
      3      -2.2320      0.00000
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      8      -0.3751      0.00000
      9       0.0661      0.00000
     10       2.0842      0.00000
     11      -0.9526      0.00000
     12      -1.2044      0.00000
     13       1.3618      0.00000
     14       3.2409      0.00000
     15       1.9718      0.00000
     16      -2.2672      0.00000
     17      -2.2813      0.00000
     18      -0.7480      0.00000
     19      -0.8960      0.00000
     20      -0.5501      0.00000

 k-point  41 :      -0.1250    0.2917    0.0417
  band No.  band energies     occupation 
      1      -0.0100      0.00000
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      3      -3.4126      0.00000
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      8      -0.5934      0.00000
      9      -7.3142      0.00000
     10      12.6242      0.00000
     11      -2.7702      0.00000
     12       0.2411      0.00000
     13      -0.5404      0.00000
     14       2.5690      0.00000
     15       4.9793      0.00000
     16       2.7442      0.00000
     17      -4.0363      0.00000
     18      -1.2435      0.00000
     19      -4.5540      0.00000
     20      -3.4631      0.00000

 k-point  42 :      -0.0417    0.2917    0.0417
  band No.  band energies     occupation 
      1       0.0172      0.00000
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      7      -2.7126      0.00000
      8      -1.3903      0.00000
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     10       5.2701      0.00000
     11      -1.4994      0.00000
     12      -0.4457      0.00000
     13       4.8358      0.00000
     14      -4.6114      0.00000
     15       7.7559      0.00000
     16      -2.1283      0.00000
     17       3.0016      0.00000
     18      -2.7280      0.00000
     19     -11.8793      0.00000
     20       0.4203      0.00000

 k-point  43 :       0.3750    0.3750    0.0417
  band No.  band energies     occupation 
      1       0.0090      0.00000
      2      -1.6888      0.00000
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     10      -1.5238      0.00000
     11      -6.3745      0.00000
     12       1.0834      0.00000
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     14       2.2835      0.00000
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     16      -3.7316      0.00000
     17       2.2244      0.00000
     18       0.7454      0.00000
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     20      -9.0366      0.00000

 k-point  44 :       0.4583    0.3750    0.0417
  band No.  band energies     occupation 
      1       0.0965      0.00000
      2      -2.6018      0.00000
      3       1.6973      0.00000
      4       1.2999      0.00000
      5      -1.6033      0.00000
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      7      -0.0029      0.00000
      8       1.7822      0.00000
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     10      -4.3004      0.00000
     11      -8.1978      0.00000
     12       0.6713      0.00000
     13       0.4798      0.00000
     14       5.4348      0.00000
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     16       6.3179      0.00000
     17      -6.5142      0.00000
     18       1.5449      0.00000
     19      -8.4346      0.00000
     20       0.7997      0.00000

 k-point  45 :      -0.4583    0.3750    0.0417
  band No.  band energies     occupation 
      1       0.4945      0.00000
      2      -3.2204      0.00000
      3       2.6809      0.00000
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      5      -0.9747      0.00000
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      8       2.0995      0.00000
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     10       1.0795      0.00000
     11      -4.4666      0.00000
     12       0.5744      0.00000
     13      -5.1804      0.00000
     14       5.0585      0.00000
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     16       3.1482      0.00000
     17      -2.4631      0.00000
     18      -1.9969      0.00000
     19      -7.0644      0.00000
     20      -0.0053      0.00000

 k-point  46 :      -0.3750    0.3750    0.0417
  band No.  band energies     occupation 
      1       1.4782      0.00000
      2      -3.3801      0.00000
      3       1.9445      0.00000
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      8       1.2022      0.00000
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     10       0.8481      0.00000
     11      -1.5556      0.00000
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     13      -2.7775      0.00000
     14       1.5025      0.00000
     15      -3.5633      0.00000
     16       2.4354      0.00000
     17       3.0875      0.00000
     18       3.5025      0.00000
     19      -2.1984      0.00000
     20      -5.0690      0.00000

 k-point  47 :      -0.2917    0.3750    0.0417
  band No.  band energies     occupation 
      1      -0.5010      0.00000
      2       2.6571      0.00000
      3      -2.2324      0.00000
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      8      -3.2349      0.00000
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     10       0.3392      0.00000
     11       0.1907      0.00000
     12      -1.0607      0.00000
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     14       2.6980      0.00000
     15       5.7846      0.00000
     16      -6.2649      0.00000
     17      -4.3904      0.00000
     18       2.2562      0.00000
     19      -1.3315      0.00000
     20       3.5823      0.00000

 k-point  48 :      -0.2083    0.3750    0.0417
  band No.  band energies     occupation 
      1      -0.4126      0.00000
      2       2.8032      0.00000
      3      -2.7096      0.00000
      4       0.2559      0.00000
      5      -0.5041      0.00000
      6      -1.6619      0.00000
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      8      -4.8739      0.00000
      9       6.0898      0.00000
     10       3.1379      0.00000
     11      -1.6809      0.00000
     12      -2.3277      0.00000
     13       3.9657      0.00000
     14       4.1987      0.00000
     15       4.2956      0.00000
     16      -4.0037      0.00000
     17      -7.1023      0.00000
     18      -1.8754      0.00000
     19       1.7197      0.00000
     20      -2.1363      0.00000

 k-point  49 :      -0.1250    0.3750    0.0417
  band No.  band energies     occupation 
      1      -0.2105      0.00000
      2       2.5033      0.00000
      3      -3.0818      0.00000
      4       0.8418      0.00000
      5      -5.6886      0.00000
      6       2.4422      0.00000
      7      -0.4102      0.00000
      8      -2.5966      0.00000
      9       4.2359      0.00000
     10       5.7885      0.00000
     11      -3.6653      0.00000
     12      -0.9039      0.00000
     13       1.6549      0.00000
     14       5.7135      0.00000
     15       4.9209      0.00000
     16       0.9263      0.00000
     17      -7.1783      0.00000
     18      -3.0859      0.00000
     19      -9.4916      0.00000
     20       1.7132      0.00000

 k-point  50 :      -0.0417    0.3750    0.0417
  band No.  band energies     occupation 
      1      -0.0838      0.00000
      2       2.4340      0.00000
      3      -5.1581      0.00000
      4       2.8993      0.00000
      5     -11.7751      0.00000
      6       9.6027      0.00000
      7      -2.0642      0.00000
      8      -2.8683      0.00000
      9       4.9168      0.00000
     10       5.5971      0.00000
     11      -3.3129      0.00000
     12       0.9905      0.00000
     13      -1.3061      0.00000
     14       6.4793      0.00000
     15       5.5953      0.00000
     16       5.8288      0.00000
     17      -7.3368      0.00000
     18      -3.9175      0.00000
     19      -5.0657      0.00000
     20      -8.6291      0.00000

 k-point  51 :       0.4583    0.4583    0.0417
  band No.  band energies     occupation 
      1       0.0648      0.00000
      2      -0.4456      0.00000
      3       0.5398      0.00000
      4      -0.0587      0.00000
      5      -0.5495      0.00000
      6       0.5441      0.00000
      7       0.7068      0.00000
      8      -0.3214      0.00000
      9       2.2228      0.00000
     10      -2.2812      0.00000
     11      -2.1073      0.00000
     12       0.0706      0.00000
     13      -0.7003      0.00000
     14       1.7554      0.00000
     15       6.1883      0.00000
     16       1.4612      0.00000
     17      -7.1907      0.00000
     18      -0.2001      0.00000
     19      -3.7375      0.00000
     20      -1.0945      0.00000

 k-point  52 :      -0.4583    0.4583    0.0417
  band No.  band energies     occupation 
      1       0.4061      0.00000
      2      -0.7604      0.00000
      3       0.3007      0.00000
      4       0.1423      0.00000
      5      -0.8863      0.00000
      6       0.9015      0.00000
      7      -0.7973      0.00000
      8       1.2873      0.00000
      9       0.4274      0.00000
     10      -0.5810      0.00000
     11      -1.4658      0.00000
     12       0.1511      0.00000
     13      -4.0968      0.00000
     14       4.3680      0.00000
     15      10.4744      0.00000
     16      -8.6959      0.00000
     17      -2.3481      0.00000
     18      -9.7908      0.00000
     19       1.4561      0.00000
     20       6.4435      0.00000

 k-point  53 :      -0.3750    0.4583    0.0417
  band No.  band energies     occupation 
      1      -0.9316      0.00000
      2       1.7928      0.00000
      3      -0.8680      0.00000
      4      -0.0953      0.00000
      5       0.3438      0.00000
      6      -0.4497      0.00000
      7       0.1104      0.00000
      8      -1.0313      0.00000
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     10      -0.5104      0.00000
     11       1.4957      0.00000
     12      -0.1077      0.00000
     13       3.2131      0.00000
     14      -3.0014      0.00000
     15      -7.8268      0.00000
     16       8.9310      0.00000
     17      -2.0961      0.00000
     18      -3.5965      0.00000
     19       0.6602      0.00000
     20       9.0978      0.00000

 k-point  54 :      -0.2917    0.4583    0.0417
  band No.  band energies     occupation 
      1      -1.2514      0.00000
      2       4.7045      0.00000
      3      -3.5250      0.00000
      4      -0.2032      0.00000
      5       0.5296      0.00000
      6      -1.5679      0.00000
      7      -0.6451      0.00000
      8      -2.5320      0.00000
      9       3.9088      0.00000
     10      -2.0818      0.00000
     11       4.4888      0.00000
     12      -1.6141      0.00000
     13       5.6130      0.00000
     14      -1.6780      0.00000
     15       4.8339      0.00000
     16      -6.8319      0.00000
     17      -1.8330      0.00000
     18      -5.4531      0.00000
     19      10.1924      0.00000
     20      -1.0242      0.00000

 k-point  55 :      -0.2083    0.4583    0.0417
  band No.  band energies     occupation 
      1      -1.6865      0.00000
      2       4.3428      0.00000
      3      -2.7241      0.00000
      4      -0.2933      0.00000
      5       0.2709      0.00000
      6      -2.9819      0.00000
      7       2.5058      0.00000
      8      -7.7842      0.00000
      9       7.5767      0.00000
     10      -3.4700      0.00000
     11       6.4644      0.00000
     12      -2.6785      0.00000
     13       6.2116      0.00000
     14       2.1045      0.00000
     15       1.7631      0.00000
     16      -3.4422      0.00000
     17      -0.6739      0.00000
     18     -10.2656      0.00000
     19      10.7285      0.00000
     20      -7.5638      0.00000

 k-point  56 :      -0.1250    0.4583    0.0417
  band No.  band energies     occupation 
      1      -1.5303      0.00000
      2       3.8172      0.00000
      3      -2.0907      0.00000
      4      -0.5355      0.00000
      5      -1.4447      0.00000
      6      -1.5362      0.00000
      7      -1.0047      0.00000
      8      -5.8897      0.00000
      9       9.3853      0.00000
     10      -3.3732      0.00000
     11       6.3184      0.00000
     12      -1.7451      0.00000
     13       5.2248      0.00000
     14       1.7201      0.00000
     15       4.4067      0.00000
     16       2.3766      0.00000
     17      -3.2274      0.00000
     18      -4.3940      0.00000
     19      -0.4790      0.00000
     20     -13.1063      0.00000

 k-point  57 :      -0.0417    0.4583    0.0417
  band No.  band energies     occupation 
      1      -0.8377      0.00000
      2       3.0273      0.00000
      3      -1.7431      0.00000
      4      -0.7054      0.00000
      5     -12.5738      0.00000
      6      10.2621      0.00000
      7      -2.0572      0.00000
      8      -4.9508      0.00000
      9       9.0138      0.00000
     10      -5.7615      0.00000
     11       8.8260      0.00000
     12      -0.4586      0.00000
     13       0.4433      0.00000
     14       4.5465      0.00000
     15       6.1039      0.00000
     16       7.1876      0.00000
     17      -9.1153      0.00000
     18      -4.5863      0.00000
     19      -1.4191      0.00000
     20     -10.9645      0.00000

 k-point  58 :      -0.4583   -0.4583    0.0417
  band No.  band energies     occupation 
      1      -0.1270      0.00000
      2       0.2386      0.00000
      3      -0.1641      0.00000
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      7      -0.2531      0.00000
      8       0.1157      0.00000
      9      -1.4915      0.00000
     10       1.5016      0.00000
     11       0.5867      0.00000
     12      -0.0138      0.00000
     13       1.5970      0.00000
     14      -1.8441      0.00000
     15      -7.3070      0.00000
     16      -1.1676      0.00000
     17      10.6012      0.00000
     18       5.4279      0.00000
     19       1.0727      0.00000
     20      -8.1061      0.00000

 k-point  59 :      -0.3750   -0.4583    0.0417
  band No.  band energies     occupation 
      1      -0.2088      0.00000
      2       1.4104      0.00000
      3      -0.9582      0.00000
      4      -0.5191      0.00000
      5       1.4637      0.00000
      6      -1.5021      0.00000
      7       0.4623      0.00000
      8      -1.7607      0.00000
      9      -1.9903      0.00000
     10       2.4287      0.00000
     11       4.6944      0.00000
     12      -0.5383      0.00000
     13       3.2382      0.00000
     14      -3.8780      0.00000
     15      -8.5731      0.00000
     16      -2.1652      0.00000
     17       8.6019      0.00000
     18       1.6273      0.00000
     19       4.7981      0.00000
     20      -1.9730      0.00000

 k-point  60 :      -0.2917   -0.4583    0.0417
  band No.  band energies     occupation 
      1      -0.2412      0.00000
      2       4.5403      0.00000
      3      -3.9147      0.00000
      4      -0.9539      0.00000
      5       1.4982      0.00000
      6      -2.0758      0.00000
      7      -0.4711      0.00000
      8      -2.3045      0.00000
      9       2.3716      0.00000
     10      -1.0896      0.00000
     11       7.4890      0.00000
     12      -1.5562      0.00000
     13       3.2701      0.00000
     14      -2.1592      0.00000
     15      -2.6367      0.00000
     16      -2.0127      0.00000
     17      -6.7360      0.00000
     18       5.5236      0.00000
     19       5.3788      0.00000
     20       1.6777      0.00000

 k-point  61 :      -0.2083   -0.4583    0.0417
  band No.  band energies     occupation 
      1      -0.3093      0.00000
      2       3.6147      0.00000
      3      -2.0603      0.00000
      4      -2.0332      0.00000
      5       1.3665      0.00000
      6      -7.2470      0.00000
      7       3.3399      0.00000
      8      -3.0133      0.00000
      9       5.2620      0.00000
     10      -2.7595      0.00000
     11       8.5484      0.00000
     12      -1.8025      0.00000
     13       3.0726      0.00000
     14       2.6153      0.00000
     15      -0.1718      0.00000
     16      -5.3622      0.00000
     17       8.2783      0.00000
     18     -11.3740      0.00000
     19       3.5231      0.00000
     20     -12.2862      0.00000

 k-point  62 :      -0.1250   -0.4583    0.0417
  band No.  band energies     occupation 
      1      -0.4790      0.00000
      2       3.0358      0.00000
      3       1.4279      0.00000
      4      -4.8919      0.00000
      5       0.9363      0.00000
      6      -3.1510      0.00000
      7      -1.7180      0.00000
      8      -4.5079      0.00000
      9       8.5079      0.00000
     10      -3.6695      0.00000
     11       2.4803      0.00000
     12       5.8782      0.00000
     13       2.1653      0.00000
     14      -0.1506      0.00000
     15       5.6373      0.00000
     16      -5.3282      0.00000
     17       9.4257      0.00000
     18       1.0223      0.00000
     19     -11.5797      0.00000
     20     -11.1625      0.00000

 k-point  63 :      -0.3750   -0.3750    0.0417
  band No.  band energies     occupation 
      1      -0.0292      0.00000
      2       0.8494      0.00000
      3      -1.0982      0.00000
      4       0.0988      0.00000
      5       0.5668      0.00000
      6      -0.5483      0.00000
      7      -1.0435      0.00000
      8       0.4550      0.00000
      9      -1.7778      0.00000
     10       1.9351      0.00000
     11       5.2438      0.00000
     12      -0.2590      0.00000
     13      -2.2444      0.00000
     14      -4.8555      0.00000
     15      -0.4877      0.00000
     16       5.6172      0.00000
     17      -2.5516      0.00000
     18      -0.5793      0.00000
     19       4.1567      0.00000
     20       1.0592      0.00000

 k-point  64 :      -0.2917   -0.3750    0.0417
  band No.  band energies     occupation 
      1      -0.0326      0.00000
      2       4.5534      0.00000
      3      -1.9768      0.00000
      4      -3.2967      0.00000
      5       1.7044      0.00000
      6      -1.7577      0.00000
      7      -0.1862      0.00000
      8      -1.7796      0.00000
      9      -3.3995      0.00000
     10       4.2821      0.00000
     11       9.8898      0.00000
     12      -0.3699      0.00000
     13      -5.9774      0.00000
     14       0.5986      0.00000
     15      -1.4364      0.00000
     16       5.2675      0.00000
     17      -2.3130      0.00000
     18      -6.1113      0.00000
     19       0.3447      0.00000
     20      11.8828      0.00000

 k-point  65 :      -0.2083   -0.3750    0.0417
  band No.  band energies     occupation 
      1      -0.0227      0.00000
      2       4.6183      0.00000
      3       0.9258      0.00000
      4      -6.7852      0.00000
      5       2.3158      0.00000
      6      -4.3907      0.00000
      7       1.0565      0.00000
      8      -2.5967      0.00000
      9       0.9648      0.00000
     10       1.0592      0.00000
     11       8.4812      0.00000
     12      -0.8326      0.00000
     13      -1.2877      0.00000
     14       3.5843      0.00000
     15      -1.8584      0.00000
     16       2.1005      0.00000
     17      -1.0230      0.00000
     18      -8.4212      0.00000
     19       0.0150      0.00000
     20       3.9270      0.00000

 k-point  66 :      -0.1250   -0.3750    0.0417
  band No.  band energies     occupation 
      1      -0.0306      0.00000
      2       3.2279      0.00000
      3       4.5506      0.00000
      4      -9.3236      0.00000
      5       2.7321      0.00000
      6      -3.9856      0.00000
      7      -2.8060      0.00000
      8      -1.6309      0.00000
      9       5.5747      0.00000
     10      -1.5420      0.00000
     11       4.6840      0.00000
     12       3.0245      0.00000
     13       0.7446      0.00000
     14       4.4929      0.00000
     15      -2.4749      0.00000
     16      -1.1200      0.00000
     17       4.0360      0.00000
     18      -3.3854      0.00000
     19      -9.0771      0.00000
     20      -4.4592      0.00000

 k-point  67 :      -0.2917   -0.2917    0.0417
  band No.  band energies     occupation 
      1       0.0022      0.00000
      2       3.4625      0.00000
      3      -4.0351      0.00000
      4       0.1841      0.00000
      5       0.6330      0.00000
      6      -0.5659      0.00000
      7      -1.3641      0.00000
      8       0.6174      0.00000
      9      -0.8158      0.00000
     10       1.2224      0.00000
     11       5.7279      0.00000
     12      -2.7872      0.00000
     13      -4.2035      0.00000
     14       3.1366      0.00000
     15       0.8803      0.00000
     16       0.0607      0.00000
     17      -0.9574      0.00000
     18      -2.0738      0.00000
     19      -0.0409      0.00000
     20       5.4528      0.00000

 k-point  68 :      -0.2083   -0.2917    0.0417
  band No.  band energies     occupation 
      1       0.0214      0.00000
      2       7.2942      0.00000
      3       0.9953      0.00000
      4      -9.7745      0.00000
      5       2.0868      0.00000
      6      -2.8401      0.00000
      7       1.0349      0.00000
      8      -2.0303      0.00000
      9      -1.4982      0.00000
     10       3.0442      0.00000
     11       8.5195      0.00000
     12      -4.4395      0.00000
     13      -3.6537      0.00000
     14       6.1919      0.00000
     15       0.6278      0.00000
     16       1.3331      0.00000
     17      -3.4812      0.00000
     18      -5.3251      0.00000
     19      -0.7306      0.00000
     20       2.3818      0.00000

 k-point  69 :      -0.1250   -0.2917    0.0417
  band No.  band energies     occupation 
      1       0.0377      0.00000
      2       4.4222      0.00000
      3       3.7394      0.00000
      4     -10.4522      0.00000
      5       3.5085      0.00000
      6      -2.7281      0.00000
      7      -3.7934      0.00000
      8      -0.1040      0.00000
      9      -0.9991      0.00000
     10       4.2914      0.00000
     11       7.0008      0.00000
     12      -2.3147      0.00000
     13      -1.8815      0.00000
     14       2.5272      0.00000
     15       6.3609      0.00000
     16       2.4338      0.00000
     17      -5.4901      0.00000
     18      -2.6920      0.00000
     19      -5.8518      0.00000
     20       0.8160      0.00000

 k-point  70 :      -0.2083   -0.2083    0.0417
  band No.  band energies     occupation 
      1       0.0103      0.00000
      2       6.5717      0.00000
      3       0.2765      0.00000
      4      -7.5475      0.00000
      5       0.8289      0.00000
      6      -3.9897      0.00000
      7      -1.3556      0.00000
      8       4.0356      0.00000
      9      -0.1514      0.00000
     10       0.9032      0.00000
     11       4.9944      0.00000
     12      -3.2460      0.00000
     13      -3.8581      0.00000
     14       3.5417      0.00000
     15       0.9743      0.00000
     16       0.8487      0.00000
     17      -1.7946      0.00000
     18      -0.3928      0.00000
     19      -1.6684      0.00000
     20       3.2722      0.00000

 k-point  71 :      -0.1250   -0.2083    0.0417
  band No.  band energies     occupation 
      1       0.0302      0.00000
      2       7.3419      0.00000
      3       1.8211      0.00000
      4     -11.6412      0.00000
      5       3.1828      0.00000
      6      -0.2980      0.00000
      7      -3.0926      0.00000
      8      -0.6983      0.00000
      9       0.1906      0.00000
     10       2.3263      0.00000
     11       5.8106      0.00000
     12      -3.3423      0.00000
     13      -3.3851      0.00000
     14       4.3761      0.00000
     15       4.1575      0.00000
     16       2.9298      0.00000
     17      -1.4438      0.00000
     18      -6.6085      0.00000
     19      -2.9042      0.00000
     20       4.6649      0.00000

 k-point  72 :      -0.1250   -0.1250    0.0417
  band No.  band energies     occupation 
      1       0.0092      0.00000
      2       6.3550      0.00000
      3       0.3592      0.00000
      4      -7.8094      0.00000
      5       1.3632      0.00000
      6      -1.1343      0.00000
      7       0.1949      0.00000
      8      -0.4542      0.00000
      9       0.3630      0.00000
     10       0.7316      0.00000
     11       3.7041      0.00000
     12      -2.7416      0.00000
     13      -2.8857      0.00000
     14       2.7266      0.00000
     15      -0.6747      0.00000
     16       0.6662      0.00000
     17       3.4489      0.00000
     18      -3.7481      0.00000
     19      -0.3113      0.00000
     20       4.5157      0.00000

 k-point  73 :       0.1250    0.1250    0.1250
  band No.  band energies     occupation 
      1      -0.0129      0.00000
      2      -6.0881      0.00000
      3      -5.5689      0.00000
      4      13.1654      0.00000
      5     -11.9242      0.00000
      6       6.5503      0.00000
      7       4.7899      0.00000
      8       0.8368      0.00000
      9      -1.1184      0.00000
     10      -2.9159      0.00000
     11      -1.9308      0.00000
     12       5.1549      0.00000
     13      -5.8758      0.00000
     14       3.3733      0.00000
     15       1.4859      0.00000
     16      -9.0940      0.00000
     17      -5.5666      0.00000
     18      13.0006      0.00000
     19      -2.4209      0.00000
     20      -1.1909      0.00000

 k-point  74 :       0.2083    0.1250    0.1250
  band No.  band energies     occupation 
      1      -0.0330      0.00000
      2      -7.8859      0.00000
      3      -2.0461      0.00000
      4      14.1407      0.00000
      5     -13.7024      0.00000
      6      13.5713      0.00000
      7      -1.5783      0.00000
      8       1.6726      0.00000
      9      -2.3990      0.00000
     10      -1.9416      0.00000
     11      -2.9973      0.00000
     12       2.1062      0.00000
     13       2.3987      0.00000
     14      -6.1684      0.00000
     15       4.5095      0.00000
     16     -10.8984      0.00000
     17      -3.3934      0.00000
     18      12.5090      0.00000
     19      -2.2351      0.00000
     20      -4.6014      0.00000

 k-point  75 :       0.2917    0.1250    0.1250
  band No.  band energies     occupation 
      1      -0.0526      0.00000
      2      -6.8763      0.00000
      3      -1.4985      0.00000
      4      12.8308      0.00000
      5     -13.6755      0.00000
      6       1.1632      0.00000
      7      12.8066      0.00000
      8       1.2161      0.00000
      9      -0.3871      0.00000
     10      -4.0194      0.00000
     11      -4.0956      0.00000
     12       0.7170      0.00000
     13       0.4114      0.00000
     14      -6.7747      0.00000
     15      -6.5015      0.00000
     16      -0.3654      0.00000
     17       1.1830      0.00000
     18      10.7184      0.00000
     19       1.0818      0.00000
     20      -3.0861      0.00000

 k-point  76 :       0.3750    0.1250    0.1250
  band No.  band energies     occupation 
      1      -0.0448      0.00000
      2      -3.9046      0.00000
      3      -3.6953      0.00000
      4      11.0975      0.00000
      5     -13.2800      0.00000
      6       4.4213      0.00000
      7      11.5287      0.00000
      8       1.0553      0.00000
      9       1.3442      0.00000
     10      -5.9443      0.00000
     11      -3.6968      0.00000
     12      -2.3089      0.00000
     13      -1.9989      0.00000
     14      -2.7386      0.00000
     15       5.8864      0.00000
     16      -4.9102      0.00000
     17      -6.3272      0.00000
     18       7.8048      0.00000
     19       2.1009      0.00000
     20       4.8581      0.00000

 k-point  77 :       0.4583    0.1250    0.1250
  band No.  band energies     occupation 
      1       0.0888      0.00000
      2      -2.9488      0.00000
      3      -4.4823      0.00000
      4       9.7429      0.00000
      5       7.2366      0.00000
      6     -12.7256      0.00000
      7       8.2206      0.00000
      8       3.6449      0.00000
      9      -8.4119      0.00000
     10       2.7023      0.00000
     11      -0.0062      0.00000
     12      -8.5714      0.00000
     13       0.1707      0.00000
     14       3.2970      0.00000
     15      -8.4803      0.00000
     16       1.6587      0.00000
     17      -9.1727      0.00000
     18       8.1865      0.00000
     19       6.5490      0.00000
     20      10.3038      0.00000

 k-point  78 :      -0.4583    0.1250    0.1250
  band No.  band energies     occupation 
      1       0.8997      0.00000
      2      -3.2510      0.00000
      3      -4.9764      0.00000
      4       8.7811      0.00000
      5       8.4826      0.00000
      6     -11.8629      0.00000
      7       5.8676      0.00000
      8       5.1705      0.00000
      9      -9.1046      0.00000
     10       3.6525      0.00000
     11       4.0620      0.00000
     12     -11.9352      0.00000
     13      -2.1325      0.00000
     14       1.0391      0.00000
     15      -8.5090      0.00000
     16       5.0508      0.00000
     17     -13.3366      0.00000
     18       2.1347      0.00000
     19      10.7340      0.00000
     20       6.7104      0.00000

 k-point  79 :      -0.3750    0.1250    0.1250
  band No.  band energies     occupation 
      1       0.8530      0.00000
      2      -3.0177      0.00000
      3      -5.3244      0.00000
      4       8.1226      0.00000
      5       8.6842      0.00000
      6     -10.8465      0.00000
      7       5.0008      0.00000
      8       1.9870      0.00000
      9      -4.2780      0.00000
     10       2.8468      0.00000
     11       4.0978      0.00000
     12      -8.9969      0.00000
     13      -0.0667      0.00000
     14      -5.6714      0.00000
     15      -7.2187      0.00000
     16      -9.3568      0.00000
     17      10.1379      0.00000
     18       9.9555      0.00000
     19      17.1914      0.00000
     20      -4.8992      0.00000

 k-point  80 :      -0.2917    0.1250    0.1250
  band No.  band energies     occupation 
      1       0.0931      0.00000
      2      -2.3214      0.00000
      3       7.7519      0.00000
      4      -5.4849      0.00000
      5       7.7471      0.00000
      6      -9.7767      0.00000
      7       5.1768      0.00000
      8      -1.0507      0.00000
      9       1.2969      0.00000
     10      -2.6543      0.00000
     11       2.3612      0.00000
     12      -3.3151      0.00000
     13       1.5744      0.00000
     14      -7.2721      0.00000
     15      -7.0845      0.00000
     16      -7.2752      0.00000
     17      11.7624      0.00000
     18       4.0494      0.00000
     19      14.0921      0.00000
     20      -4.8303      0.00000

 k-point  81 :      -0.2083    0.1250    0.1250
  band No.  band energies     occupation 
      1      -0.0071      0.00000
      2      -2.5589      0.00000
      3       7.6919      0.00000
      4      -5.4122      0.00000
      5       5.2919      0.00000
      6      -8.6625      0.00000
      7       6.0248      0.00000
      8      -1.4181      0.00000
      9       9.8608      0.00000
     10     -10.6476      0.00000
     11       0.1265      0.00000
     12      -0.3054      0.00000
     13       5.9054      0.00000
     14      -7.9912      0.00000
     15      -0.9021      0.00000
     16      -3.8182      0.00000
     17      -1.1850      0.00000
     18       2.0659      0.00000
     19      10.0959      0.00000
     20      -2.5874      0.00000

 k-point  82 :      -0.1250    0.1250    0.1250
  band No.  band energies     occupation 
      1      -0.0095      0.00000
      2      -3.3957      0.00000
      3       8.0380      0.00000
      4      -4.9109      0.00000
      5       2.2301      0.00000
      6       6.8576      0.00000
      7      -7.8104      0.00000
      8      -0.4120      0.00000
      9      -0.5102      0.00000
     10      -0.0122      0.00000
     11      -1.5462      0.00000
     12       2.7177      0.00000
     13      -6.0234      0.00000
     14       4.8119      0.00000
     15       7.6434      0.00000
     16      -7.6304      0.00000
     17     -12.8762      0.00000
     18       9.6321      0.00000
     19       5.3114      0.00000
     20      -2.9888      0.00000

 k-point  83 :       0.2083    0.2083    0.1250
  band No.  band energies     occupation 
      1      -0.0260      0.00000
      2      -5.0894      0.00000
      3      -1.0727      0.00000
      4       8.2009      0.00000
      5      -3.0561      0.00000
      6       3.3494      0.00000
      7      -0.3391      0.00000
      8       1.5062      0.00000
      9      -1.3987      0.00000
     10      -2.2159      0.00000
     11      -5.0193      0.00000
     12       4.5130      0.00000
     13       2.5732      0.00000
     14      -4.4892      0.00000
     15       1.8750      0.00000
     16      -1.7948      0.00000
     17      -6.8119      0.00000
     18       6.8189      0.00000
     19       1.2011      0.00000
     20      -2.3785      0.00000

 k-point  84 :       0.2917    0.2083    0.1250
  band No.  band energies     occupation 
      1      -0.0463      0.00000
      2      -6.9790      0.00000
      3      -1.5132      0.00000
      4      12.0663      0.00000
      5      -5.8904      0.00000
      6       0.9848      0.00000
      7       5.8266      0.00000
      8       0.5970      0.00000
      9       0.2131      0.00000
     10      -3.6711      0.00000
     11      -4.9208      0.00000
     12       1.4146      0.00000
     13       1.1706      0.00000
     14      -4.3883      0.00000
     15      -4.8606      0.00000
     16      -4.4842      0.00000
     17       8.2174      0.00000
     18       3.3960      0.00000
     19       3.3543      0.00000
     20      -3.6294      0.00000

 k-point  85 :       0.3750    0.2083    0.1250
  band No.  band energies     occupation 
      1      -0.0464      0.00000
      2      -6.1647      0.00000
      3      -1.2061      0.00000
      4      10.7380      0.00000
      5      -6.7457      0.00000
      6       4.1658      0.00000
      7       6.8166      0.00000
      8      -1.6440      0.00000
      9       2.0685      0.00000
     10      -5.5126      0.00000
     11      -3.8698      0.00000
     12      -2.0732      0.00000
     13      -1.7989      0.00000
     14       0.0469      0.00000
     15      -6.5080      0.00000
     16      -4.2437      0.00000
     17       7.4163      0.00000
     18       3.7157      0.00000
     19       7.1163      0.00000
     20      -1.3864      0.00000

 k-point  86 :       0.4583    0.2083    0.1250
  band No.  band energies     occupation 
      1       0.0402      0.00000
      2      -3.6436      0.00000
      3      -3.2181      0.00000
      4       9.3024      0.00000
      5      -3.4565      0.00000
      6       2.5328      0.00000
      7       4.1982      0.00000
      8       1.2505      0.00000
      9      -6.6709      0.00000
     10       2.6546      0.00000
     11      -1.7470      0.00000
     12      -6.5068      0.00000
     13       1.1285      0.00000
     14      -6.1008      0.00000
     15       3.5130      0.00000
     16      -0.4049      0.00000
     17      -6.0402      0.00000
     18       2.6161      0.00000
     19      12.4891      0.00000
     20       5.6315      0.00000

 k-point  87 :      -0.4583    0.2083    0.1250
  band No.  band energies     occupation 
      1       0.5213      0.00000
      2      -3.1892      0.00000
      3      -3.7725      0.00000
      4       8.0599      0.00000
      5       6.9203      0.00000
      6      -7.1028      0.00000
      7       1.8449      0.00000
      8       5.3147      0.00000
      9      -9.1014      0.00000
     10       4.8039      0.00000
     11      -0.3384      0.00000
     12      -7.2017      0.00000
     13      -1.6190      0.00000
     14       1.4564      0.00000
     15      -8.2295      0.00000
     16       2.8151      0.00000
     17     -12.8366      0.00000
     18       0.2355      0.00000
     19      10.2283      0.00000
     20      13.5016      0.00000

 k-point  88 :      -0.3750    0.2083    0.1250
  band No.  band energies     occupation 
      1       1.5548      0.00000
      2      -3.8095      0.00000
      3      -2.9313      0.00000
      4       6.0510      0.00000
      5       8.9064      0.00000
      6      -8.2895      0.00000
      7       1.5179      0.00000
      8       2.1262      0.00000
      9      -4.5211      0.00000
     10       3.1934      0.00000
     11      -1.6188      0.00000
     12      -1.7321      0.00000
     13      -2.8862      0.00000
     14      -3.4895      0.00000
     15      -6.7136      0.00000
     16      -3.9257      0.00000
     17      -0.9235      0.00000
     18      10.0036      0.00000
     19      11.5492      0.00000
     20      -0.8412      0.00000

 k-point  89 :      -0.2917    0.2083    0.1250
  band No.  band energies     occupation 
      1       0.2162      0.00000
      2      -2.3508      0.00000
      3       0.2798      0.00000
      4       2.1297      0.00000
      5       8.0875      0.00000
      6      -6.8551      0.00000
      7       1.9965      0.00000
      8      -2.7771      0.00000
      9       2.4896      0.00000
     10      -2.9655      0.00000
     11      -0.2874      0.00000
     12       2.0126      0.00000
     13      -1.3640      0.00000
     14      -6.4229      0.00000
     15      -6.5135      0.00000
     16      -3.3094      0.00000
     17       9.3617      0.00000
     18       2.6991      0.00000
     19      10.4971      0.00000
     20      -0.4978      0.00000

 k-point  90 :      -0.2083    0.2083    0.1250
  band No.  band energies     occupation 
      1       0.0148      0.00000
      2      -2.2625      0.00000
      3       2.4749      0.00000
      4      -0.2988      0.00000
      5       4.9686      0.00000
      6      -3.7470      0.00000
      7       1.8791      0.00000
      8      -3.0436      0.00000
      9       9.5816      0.00000
     10      -9.7054      0.00000
     11       0.6302      0.00000
     12       0.4227      0.00000
     13       2.0190      0.00000
     14      -5.0049      0.00000
     15      -4.4014      0.00000
     16      -5.3562      0.00000
     17       6.1376      0.00000
     18       2.3968      0.00000
     19       7.2283      0.00000
     20      -3.0522      0.00000

 k-point  91 :      -0.1250    0.2083    0.1250
  band No.  band energies     occupation 
      1      -0.0031      0.00000
      2      -2.3152      0.00000
      3       2.8521      0.00000
      4      -0.6303      0.00000
      5       1.2506      0.00000
      6      -0.5619      0.00000
      7      -0.0287      0.00000
      8      -0.5051      0.00000
      9       1.1494      0.00000
     10      -1.1772      0.00000
     11       0.0230      0.00000
     12       1.1279      0.00000
     13      -2.1722      0.00000
     14      -4.2680      0.00000
     15       7.1702      0.00000
     16      -2.1492      0.00000
     17      -2.0938      0.00000
     18       0.8135      0.00000
     19       2.3620      0.00000
     20      -1.5470      0.00000

 k-point  92 :       0.2917    0.2917    0.1250
  band No.  band energies     occupation 
      1      -0.0265      0.00000
      2      -4.8012      0.00000
      3      -0.8464      0.00000
      4       7.0826      0.00000
      5      -1.8852      0.00000
      6       0.1320      0.00000
      7       3.9318      0.00000
      8       0.0077      0.00000
      9       0.3263      0.00000
     10      -2.8611      0.00000
     11      -7.6281      0.00000
     12       4.5858      0.00000
     13       4.3907      0.00000
     14      -6.0068      0.00000
     15      -2.3684      0.00000
     16      -1.9920      0.00000
     17       4.0263      0.00000
     18       1.5584      0.00000
     19       4.2543      0.00000
     20      -2.5425      0.00000

 k-point  93 :       0.3750    0.2917    0.1250
  band No.  band energies     occupation 
      1      -0.0272      0.00000
      2      -6.7334      0.00000
      3      -0.9306      0.00000
      4       9.8398      0.00000
      5      -3.4759      0.00000
      6      10.8221      0.00000
      7      -8.3148      0.00000
      8       3.6206      0.00000
      9       2.5999      0.00000
     10      -4.8186      0.00000
     11      -6.5138      0.00000
     12       0.2709      0.00000
     13       0.5828      0.00000
     14       0.3602      0.00000
     15      -4.9454      0.00000
     16      -2.8691      0.00000
     17       4.9052      0.00000
     18       1.1465      0.00000
     19       7.9361      0.00000
     20      -1.0147      0.00000

 k-point  94 :       0.4583    0.2917    0.1250
  band No.  band energies     occupation 
      1       0.0403      0.00000
      2      -6.0347      0.00000
      3      -0.7292      0.00000
      4       8.5997      0.00000
      5      -4.1198      0.00000
      6      10.9186      0.00000
      7      -7.7692      0.00000
      8       4.9180      0.00000
      9      -6.7823      0.00000
     10       4.2603      0.00000
     11      -5.2593      0.00000
     12      -3.1878      0.00000
     13       0.3657      0.00000
     14      -2.5866      0.00000
     15      -1.4734      0.00000
     16       4.6129      0.00000
     17      -4.3084      0.00000
     18      12.0043      0.00000
     19      -3.2573      0.00000
     20       7.3353      0.00000

 k-point  95 :      -0.4583    0.2917    0.1250
  band No.  band energies     occupation 
      1       0.3680      0.00000
      2      -3.9357      0.00000
      3      -2.0713      0.00000
      4       6.9331      0.00000
      5      -1.3068      0.00000
      6       5.7564      0.00000
      7      -5.7405      0.00000
      8       7.1066      0.00000
      9      -8.5789      0.00000
     10       5.6546      0.00000
     11      -5.3823      0.00000
     12      -0.4961      0.00000
     13      -1.3513      0.00000
     14      -6.5541      0.00000
     15      -0.2394      0.00000
     16       3.3258      0.00000
     17      -7.3477      0.00000
     18      14.0862      0.00000
     19      -7.5623      0.00000
     20       9.0353      0.00000

 k-point  96 :      -0.3750    0.2917    0.1250
  band No.  band energies     occupation 
      1       1.7535      0.00000
      2      -4.3666      0.00000
      3      -0.6283      0.00000
      4       3.9800      0.00000
      5       2.9803      0.00000
      6      -1.3193      0.00000
      7      -5.4773      0.00000
      8       9.9621      0.00000
      9      -7.4874      0.00000
     10       4.5737      0.00000
     11      -5.9396      0.00000
     12       3.5967      0.00000
     13      -5.7225      0.00000
     14      -5.8070      0.00000
     15       0.0192      0.00000
     16      -0.4872      0.00000
     17      -0.3877      0.00000
     18      15.1961      0.00000
     19     -14.7573      0.00000
     20       7.6928      0.00000

 k-point  97 :      -0.2917    0.2917    0.1250
  band No.  band energies     occupation 
      1       0.4194      0.00000
      2      -2.5668      0.00000
      3       1.0798      0.00000
      4       1.3681      0.00000
      5       7.3494      0.00000
      6      -6.5624      0.00000
      7       2.9711      0.00000
      8      -3.7411      0.00000
      9       0.7440      0.00000
     10      -0.7317      0.00000
     11      -1.0786      0.00000
     12       4.1047      0.00000
     13      -4.5105      0.00000
     14      -7.3000      0.00000
     15      -0.9440      0.00000
     16       1.7537      0.00000
     17      -2.4822      0.00000
     18      15.1762      0.00000
     19      -4.2524      0.00000
     20      -1.7619      0.00000

 k-point  98 :      -0.2083    0.2917    0.1250
  band No.  band energies     occupation 
      1       0.0293      0.00000
      2      -1.6342      0.00000
      3       1.4569      0.00000
      4       0.1833      0.00000
      5       4.8969      0.00000
      6      -4.6701      0.00000
      7       0.7518      0.00000
      8      -1.2062      0.00000
      9       2.2498      0.00000
     10      -2.2948      0.00000
     11       0.2426      0.00000
     12       2.3821      0.00000
     13      -2.3647      0.00000
     14      -4.3034      0.00000
     15       2.8934      0.00000
     16      -2.0426      0.00000
     17       1.6429      0.00000
     18       2.4300      0.00000
     19       0.3865      0.00000
     20       2.9253      0.00000

 k-point  99 :      -0.1250    0.2917    0.1250
  band No.  band energies     occupation 
      1      -0.0035      0.00000
      2       1.8199      0.00000
      3      -1.8930      0.00000
      4       0.1122      0.00000
      5      -1.9919      0.00000
      6       1.6527      0.00000
      7      -1.4181      0.00000
      8       1.7934      0.00000
      9     -13.7921      0.00000
     10      13.8501      0.00000
     11      -0.2836      0.00000
     12      -1.2124      0.00000
     13       1.5318      0.00000
     14       0.1987      0.00000
     15       1.6502      0.00000
     16       2.1290      0.00000
     17      -2.0325      0.00000
     18      -0.9236      0.00000
     19      -2.5462      0.00000
     20       1.0849      0.00000

 k-point 100 :       0.3750    0.3750    0.1250
  band No.  band energies     occupation 
      1       0.0047      0.00000
      2      -5.0270      0.00000
      3       6.3861      0.00000
      4      -0.5651      0.00000
      5      -1.4906      0.00000
      6       1.8703      0.00000
      7       3.8432      0.00000
      8      -1.8290      0.00000
      9       2.4269      0.00000
     10      -3.8058      0.00000
     11      -9.4606      0.00000
     12       3.8068      0.00000
     13       2.6156      0.00000
     14       0.8618      0.00000
     15      -3.1879      0.00000
     16      -2.0596      0.00000
     17       1.9168      0.00000
     18       5.2331      0.00000
     19       0.4442      0.00000
     20      -5.1398      0.00000

 k-point 101 :       0.4583    0.3750    0.1250
  band No.  band energies     occupation 
      1       0.0738      0.00000
      2      -5.9644      0.00000
      3       0.8057      0.00000
      4       6.1759      0.00000
      5      -2.6780      0.00000
      6       3.4475      0.00000
      7      -0.5785      0.00000
      8       3.1239      0.00000
      9      -2.8319      0.00000
     10       1.2192      0.00000
     11      -8.7811      0.00000
     12      -0.1213      0.00000
     13       4.8296      0.00000
     14      -4.9960      0.00000
     15       1.7209      0.00000
     16      -4.4248      0.00000
     17       2.6959      0.00000
     18       9.7513      0.00000
     19      -5.6827      0.00000
     20      -8.4224      0.00000

 k-point 102 :      -0.4583    0.3750    0.1250
  band No.  band energies     occupation 
      1       0.3428      0.00000
      2      -5.3461      0.00000
      3       0.5795      0.00000
      4       5.2707      0.00000
      5      -3.0927      0.00000
      6       4.8309      0.00000
      7      -1.7837      0.00000
      8       4.6057      0.00000
      9      -9.0135      0.00000
     10       6.8297      0.00000
     11      -8.5537      0.00000
     12       3.1071      0.00000
     13       4.3160      0.00000
     14      -7.9668      0.00000
     15      -1.1121      0.00000
     16       4.2737      0.00000
     17      12.4746      0.00000
     18      -6.7826      0.00000
     19     -11.7895      0.00000
     20       2.6867      0.00000

 k-point 103 :      -0.3750    0.3750    0.1250
  band No.  band energies     occupation 
      1       1.4155      0.00000
      2      -4.8480      0.00000
      3       1.8058      0.00000
      4       2.0935      0.00000
      5      -0.4726      0.00000
      6       3.7557      0.00000
      7      -3.5231      0.00000
      8       4.0243      0.00000
      9      -6.1563      0.00000
     10       4.6885      0.00000
     11      -5.5655      0.00000
     12       3.3652      0.00000
     13       0.7471      0.00000
     14      -6.4428      0.00000
     15      -2.8001      0.00000
     16       1.5182      0.00000
     17      -2.2010      0.00000
     18      12.6709      0.00000
     19      -2.0106      0.00000
     20      -8.8451      0.00000

 k-point 104 :      -0.2917    0.3750    0.1250
  band No.  band energies     occupation 
      1       0.5255      0.00000
      2      -2.3051      0.00000
      3       1.4296      0.00000
      4       0.4787      0.00000
      5       0.4671      0.00000
      6       0.3048      0.00000
      7      -3.8481      0.00000
      8       3.8853      0.00000
      9      -1.0994      0.00000
     10       0.8139      0.00000
     11      -1.1465      0.00000
     12       1.6947      0.00000
     13      -0.3884      0.00000
     14      -5.0910      0.00000
     15      -0.1075      0.00000
     16       1.8207      0.00000
     17       6.3828      0.00000
     18      -7.4577      0.00000
     19       3.8339      0.00000
     20      -2.2482      0.00000

 k-point 105 :      -0.2083    0.3750    0.1250
  band No.  band energies     occupation 
      1      -0.1226      0.00000
      2       1.7189      0.00000
      3      -1.3273      0.00000
      4      -0.3616      0.00000
      5      -2.6319      0.00000
      6       2.3812      0.00000
      7      -0.8205      0.00000
      8       1.3129      0.00000
      9      -0.6781      0.00000
     10       0.5482      0.00000
     11       0.2212      0.00000
     12      -2.2641      0.00000
     13       2.1722      0.00000
     14       6.7007      0.00000
     15      -4.3623      0.00000
     16       0.2561      0.00000
     17      -1.3268      0.00000
     18      -3.0920      0.00000
     19       4.5985      0.00000
     20      -0.7999      0.00000

 k-point 106 :      -0.1250    0.3750    0.1250
  band No.  band energies     occupation 
      1      -0.1003      0.00000
      2       2.1825      0.00000
      3      -1.4559      0.00000
      4      -0.7572      0.00000
      5      -7.7564      0.00000
      6       6.9456      0.00000
      7      -3.4889      0.00000
      8       4.6254      0.00000
      9      -3.8950      0.00000
     10       4.1458      0.00000
     11      -0.3960      0.00000
     12      -2.9699      0.00000
     13       1.7842      0.00000
     14       6.6951      0.00000
     15       2.6402      0.00000
     16       1.5715      0.00000
     17      -5.2259      0.00000
     18      -6.7536      0.00000
     19      -1.3346      0.00000
     20      -2.5079      0.00000

 k-point 107 :       0.4583    0.4583    0.1250
  band No.  band energies     occupation 
      1       0.1212      0.00000
      2      -3.2123      0.00000
      3       3.7584      0.00000
      4      -0.3042      0.00000
      5      -1.1854      0.00000
      6       1.3704      0.00000
      7       2.9178      0.00000
      8      -1.2225      0.00000
      9       1.7675      0.00000
     10      -2.2150      0.00000
     11      -6.5362      0.00000
     12       0.8947      0.00000
     13      -2.1812      0.00000
     14       3.8355      0.00000
     15       3.8553      0.00000
     16       5.2371      0.00000
     17      -5.6543      0.00000
     18      -0.0611      0.00000
     19      -3.7433      0.00000
     20      -2.6396      0.00000

 k-point 108 :      -0.4583    0.4583    0.1250
  band No.  band energies     occupation 
      1       0.4002      0.00000
      2      -2.5707      0.00000
      3       1.2237      0.00000
      4       1.3432      0.00000
      5      -2.0659      0.00000
      6       2.3158      0.00000
      7      -0.7133      0.00000
      8       3.0281      0.00000
      9      -5.0345      0.00000
     10       3.8764      0.00000
     11      -6.7129      0.00000
     12       2.3839      0.00000
     13      -6.1274      0.00000
     14       7.8414      0.00000
     15       3.4153      0.00000
     16       4.3047      0.00000
     17      -3.5206      0.00000
     18      -9.4946      0.00000
     19      -1.5783      0.00000
     20       3.0841      0.00000

 k-point 109 :      -0.3750    0.4583    0.1250
  band No.  band energies     occupation 
      1       1.2767      0.00000
      2      -2.3182      0.00000
      3       0.4548      0.00000
      4       0.7389      0.00000
      5      -1.0405      0.00000
      6       1.3106      0.00000
      7      -1.4112      0.00000
      8       2.4162      0.00000
      9      -4.4665      0.00000
     10       3.8899      0.00000
     11      -3.3640      0.00000
     12       2.0092      0.00000
     13      -7.3878      0.00000
     14       7.6828      0.00000
     15       8.9079      0.00000
     16     -13.0511      0.00000
     17       0.1840      0.00000
     18       2.7632      0.00000
     19       8.9346      0.00000
     20     -12.2298      0.00000

 k-point 110 :      -0.2917    0.4583    0.1250
  band No.  band energies     occupation 
      1      -1.7122      0.00000
      2       3.4560      0.00000
      3      -1.3192      0.00000
      4      -0.5739      0.00000
      5       0.1524      0.00000
      6      -1.1081      0.00000
      7       1.5133      0.00000
      8      -1.7620      0.00000
      9       2.2659      0.00000
     10      -1.8969      0.00000
     11       1.9371      0.00000
     12      -1.2013      0.00000
     13      -4.4747      0.00000
     14       6.4418      0.00000
     15       2.6830      0.00000
     16      -0.9094      0.00000
     17      -1.0053      0.00000
     18      -0.1499      0.00000
     19      -5.8441      0.00000
     20       6.8300      0.00000

 k-point 111 :      -0.2083    0.4583    0.1250
  band No.  band energies     occupation 
      1      -1.5714      0.00000
      2       4.1183      0.00000
      3      -1.1921      0.00000
      4      -1.7622      0.00000
      5      -1.5230      0.00000
      6      -0.0728      0.00000
      7       4.3258      0.00000
      8      -5.8534      0.00000
      9       3.9825      0.00000
     10      -2.6490      0.00000
     11       3.7438      0.00000
     12      -3.8708      0.00000
     13       3.3885      0.00000
     14       7.2049      0.00000
     15       0.5472      0.00000
     16      -1.3492      0.00000
     17      -4.2031      0.00000
     18      -7.3458      0.00000
     19       6.3012      0.00000
     20       1.1939      0.00000

 k-point 112 :      -0.1250    0.4583    0.1250
  band No.  band energies     occupation 
      1      -0.8913      0.00000
      2       3.1148      0.00000
      3       0.5073      0.00000
      4      -3.2860      0.00000
      5      -9.1946      0.00000
      6       8.1519      0.00000
      7      -2.2291      0.00000
      8       1.5113      0.00000
      9       1.3455      0.00000
     10      -0.7669      0.00000
     11       2.6691      0.00000
     12      -3.4322      0.00000
     13       4.5930      0.00000
     14       3.8172      0.00000
     15       5.9061      0.00000
     16       0.8550      0.00000
     17       0.1340      0.00000
     18     -16.9417      0.00000
     19       0.2908      0.00000
     20       2.9419      0.00000

 k-point 113 :      -0.4583   -0.4583    0.1250
  band No.  band energies     occupation 
      1       0.4953      0.00000
      2      -0.9483      0.00000
      3       0.5783      0.00000
      4      -0.0599      0.00000
      5      -0.3397      0.00000
      6       0.3802      0.00000
      7       0.7133      0.00000
      8      -0.3091      0.00000
      9       0.3221      0.00000
     10      -0.3442      0.00000
     11      -1.2034      0.00000
     12       0.0039      0.00000
     13      -2.7247      0.00000
     14       3.0568      0.00000
     15       6.3835      0.00000
     16      -7.4237      0.00000
     17       3.0160      0.00000
     18      -1.1210      0.00000
     19      -2.8289      0.00000
     20      -3.2201      0.00000

 k-point 114 :      -0.3750   -0.4583    0.1250
  band No.  band energies     occupation 
      1      -0.7665      0.00000
      2       1.4230      0.00000
      3      -0.4232      0.00000
      4      -0.3597      0.00000
      5       0.9987      0.00000
      6      -1.0817      0.00000
      7       1.3005      0.00000
      8      -2.2339      0.00000
      9       2.2121      0.00000
     10      -1.7266      0.00000
     11       2.3818      0.00000
     12      -0.9074      0.00000
     13       5.8388      0.00000
     14      -5.0767      0.00000
     15     -11.3672      0.00000
     16      12.3801      0.00000
     17       0.4729      0.00000
     18      -2.5182      0.00000
     19      -6.6031      0.00000
     20      11.2080      0.00000

 k-point 115 :      -0.2917   -0.4583    0.1250
  band No.  band energies     occupation 
      1      -0.6846      0.00000
      2       3.8731      0.00000
      3      -0.9984      0.00000
      4      -2.6626      0.00000
      5       2.4391      0.00000
      6      -3.3160      0.00000
      7       1.2434      0.00000
      8      -3.8544      0.00000
      9       8.5062      0.00000
     10      -6.9071      0.00000
     11       7.9468      0.00000
     12      -4.2069      0.00000
     13       8.9863      0.00000
     14      -7.5626      0.00000
     15      -0.5679      0.00000
     16      -2.6561      0.00000
     17       6.8443      0.00000
     18      -7.4118      0.00000
     19      -2.9029      0.00000
     20       9.4981      0.00000

 k-point 116 :      -0.2083   -0.4583    0.1250
  band No.  band energies     occupation 
      1      -0.7547      0.00000
      2       4.3795      0.00000
      3       0.0869      0.00000
      4      -4.5472      0.00000
      5       0.8319      0.00000
      6      -6.3383      0.00000
      7       5.8101      0.00000
      8      -6.0217      0.00000
      9       8.4433      0.00000
     10      -5.8467      0.00000
     11       7.3033      0.00000
     12      -3.4945      0.00000
     13       2.2456      0.00000
     14       5.4023      0.00000
     15       1.2505      0.00000
     16      -2.5512      0.00000
     17       5.5853      0.00000
     18     -13.7078      0.00000
     19      12.3042      0.00000
     20      -5.6535      0.00000

 k-point 117 :      -0.3750   -0.3750    0.1250
  band No.  band energies     occupation 
      1      -0.2553      0.00000
      2       1.7989      0.00000
      3      -1.9272      0.00000
      4       0.1807      0.00000
      5       0.8762      0.00000
      6      -0.9942      0.00000
      7      -1.9835      0.00000
      8       0.8445      0.00000
      9      -1.0015      0.00000
     10       1.1485      0.00000
     11       3.7008      0.00000
     12      -0.1440      0.00000
     13       3.7576      0.00000
     14      -5.5594      0.00000
     15      -4.9137      0.00000
     16      -3.8925      0.00000
     17       5.6866      0.00000
     18       6.2004      0.00000
     19      -0.4841      0.00000
     20       3.2551      0.00000

 k-point 118 :      -0.2917   -0.3750    0.1250
  band No.  band energies     occupation 
      1      -0.1921      0.00000
      2       4.2986      0.00000
      3      -1.5783      0.00000
      4      -3.2371      0.00000
      5       2.4381      0.00000
      6      -2.8828      0.00000
      7       0.3665      0.00000
      8      -3.1629      0.00000
      9       4.9761      0.00000
     10      -3.5061      0.00000
     11       9.0158      0.00000
     12      -2.1436      0.00000
     13       1.3079      0.00000
     14      -2.3481      0.00000
     15       0.0069      0.00000
     16      -8.1725      0.00000
     17      -1.4150      0.00000
     18       3.4723      0.00000
     19      10.4445      0.00000
     20      -1.8557      0.00000

 k-point 119 :      -0.2083   -0.3750    0.1250
  band No.  band energies     occupation 
      1      -0.1491      0.00000
      2       5.9731      0.00000
      3       0.2156      0.00000
      4      -7.3480      0.00000
      5       3.5464      0.00000
      6      -6.9974      0.00000
      7       3.6810      0.00000
      8      -4.7074      0.00000
      9       8.1310      0.00000
     10      -5.8093      0.00000
     11       6.9596      0.00000
     12       0.0659      0.00000
     13      -2.0753      0.00000
     14       7.1871      0.00000
     15      -0.5953      0.00000
     16      -4.2043      0.00000
     17       5.3360      0.00000
     18     -13.2419      0.00000
     19      10.8781      0.00000
     20       6.2768      0.00000

 k-point 120 :      -0.2917   -0.2917    0.1250
  band No.  band energies     occupation 
      1      -0.0462      0.00000
      2       4.6216      0.00000
      3      -5.5654      0.00000
      4       0.4321      0.00000
      5       1.3590      0.00000
      6      -1.6103      0.00000
      7      -3.5150      0.00000
      8       1.5145      0.00000
      9      -2.5537      0.00000
     10       3.4049      0.00000
     11       8.9919      0.00000
     12      -2.4961      0.00000
     13      -0.2006      0.00000
     14      -0.7872      0.00000
     15      -3.0995      0.00000
     16       4.4786      0.00000
     17      -1.2566      0.00000
     18      -5.3992      0.00000
     19       1.3533      0.00000
     20       7.9713      0.00000

 k-point 121 :      -0.2083   -0.2917    0.1250
  band No.  band energies     occupation 
      1      -0.0077      0.00000
      2       6.6586      0.00000
      3       0.2940      0.00000
      4      -8.5100      0.00000
      5       2.9792      0.00000
      6      -4.7007      0.00000
      7       1.8541      0.00000
      8      -3.2176      0.00000
      9      -2.6170      0.00000
     10       4.4667      0.00000
     11       7.6195      0.00000
     12       0.9445      0.00000
     13      -3.1336      0.00000
     14       3.2388      0.00000
     15      -0.1077      0.00000
     16       3.8823      0.00000
     17      -3.7898      0.00000
     18      -9.0766      0.00000
     19       0.8696      0.00000
     20      12.4013      0.00000

 k-point 122 :      -0.2083   -0.2083    0.1250
  band No.  band energies     occupation 
      1       0.0169      0.00000
      2       4.9001      0.00000
      3       0.7044      0.00000
      4      -6.7094      0.00000
      5       1.6458      0.00000
      6      -2.7023      0.00000
      7      -3.9758      0.00000
      8       2.6840      0.00000
      9      -1.3323      0.00000
     10       3.2601      0.00000
     11       8.7307      0.00000
     12      -4.4184      0.00000
     13      -5.3767      0.00000
     14       2.5747      0.00000
     15       7.2774      0.00000
     16      -0.7204      0.00000
     17      -2.8260      0.00000
     18      -1.1248      0.00000
     19      -4.9150      0.00000
     20       1.1846      0.00000

 k-point 123 :       0.2083    0.2083    0.2083
  band No.  band energies     occupation 
      1      -0.0297      0.00000
      2      -4.0543      0.00000
      3      -6.0211      0.00000
      4      11.3289      0.00000
      5     -11.1648      0.00000
      6       9.6617      0.00000
      7       2.6580      0.00000
      8       2.1845      0.00000
      9      -3.0594      0.00000
     10      -5.3676      0.00000
     11      -1.5676      0.00000
     12       5.0825      0.00000
     13      -6.3450      0.00000
     14       3.8405      0.00000
     15       1.0928      0.00000
     16      -5.7227      0.00000
     17       9.5515      0.00000
     18      -6.5071      0.00000
     19      -1.0628      0.00000
     20       5.2173      0.00000

 k-point 124 :       0.2917    0.2083    0.2083
  band No.  band energies     occupation 
      1      -0.0496      0.00000
      2      -4.4450      0.00000
      3      -4.2614      0.00000
      4      12.2710      0.00000
      5     -13.1388      0.00000
      6       9.0423      0.00000
      7       4.9605      0.00000
      8       2.1231      0.00000
      9      -0.3235      0.00000
     10      -4.1537      0.00000
     11      -6.1679      0.00000
     12       2.5343      0.00000
     13       0.5318      0.00000
     14      -6.9385      0.00000
     15      -6.0191      0.00000
     16      -6.6756      0.00000
     17       7.0021      0.00000
     18       9.5213      0.00000
     19       0.7395      0.00000
     20       1.2102      0.00000

 k-point 125 :       0.3750    0.2083    0.2083
  band No.  band energies     occupation 
      1      -0.0535      0.00000
      2      -5.9804      0.00000
      3      -1.2687      0.00000
      4      11.2494      0.00000
      5     -13.5415      0.00000
      6       3.2608      0.00000
      7      13.5060      0.00000
      8      -0.8261      0.00000
      9       1.4028      0.00000
     10      -5.7851      0.00000
     11      -2.6241      0.00000
     12      -2.7359      0.00000
     13      -2.4991      0.00000
     14      -0.7296      0.00000
     15      -7.0915      0.00000
     16       7.9304      0.00000
     17      -7.1542      0.00000
     18       7.8569      0.00000
     19      -1.1511      0.00000
     20       5.4914      0.00000

 k-point 126 :       0.4583    0.2083    0.2083
  band No.  band energies     occupation 
      1       0.0058      0.00000
      2      -5.2285      0.00000
      3      -1.2045      0.00000
      4       9.6505      0.00000
      5       5.1878      0.00000
      6     -13.3109      0.00000
      7      13.3702      0.00000
      8      -2.1275      0.00000
      9      -7.7174      0.00000
     10       3.2061      0.00000
     11      -0.3225      0.00000
     12      -6.1879      0.00000
     13      -4.5844      0.00000
     14       2.3959      0.00000
     15      -7.1827      0.00000
     16       6.4813      0.00000
     17     -10.9961      0.00000
     18       9.5752      0.00000
     19       2.9191      0.00000
     20      11.8169      0.00000

 k-point 127 :      -0.4583    0.2083    0.2083
  band No.  band energies     occupation 
      1       0.3071      0.00000
      2      -3.3863      0.00000
      3      -2.9368      0.00000
      4       8.3241      0.00000
      5       6.1285      0.00000
      6     -12.5917      0.00000
      7       8.4946      0.00000
      8       3.3725      0.00000
      9      -9.4618      0.00000
     10       4.4604      0.00000
     11       1.0899      0.00000
     12      -7.2330      0.00000
     13      -0.8359      0.00000
     14       3.2193      0.00000
     15      -8.8179      0.00000
     16      -0.4716      0.00000
     17     -10.7930      0.00000
     18      10.9907      0.00000
     19       5.8402      0.00000
     20       6.8111      0.00000

 k-point 128 :      -0.3750    0.2083    0.2083
  band No.  band energies     occupation 
      1       1.6613      0.00000
      2      -4.0046      0.00000
      3      -3.5839      0.00000
      4       7.3757      0.00000
      5       6.4187      0.00000
      6     -11.3850      0.00000
      7       5.4635      0.00000
      8       0.6041      0.00000
      9      -2.5120      0.00000
     10       5.1374      0.00000
     11       0.3705      0.00000
     12      -6.5381      0.00000
     13       0.8378      0.00000
     14      -2.8570      0.00000
     15      -9.3729      0.00000
     16       0.6025      0.00000
     17     -13.3141      0.00000
     18      14.9833      0.00000
     19       5.6871      0.00000
     20       5.2518      0.00000

 k-point 129 :      -0.2917    0.2083    0.2083
  band No.  band energies     occupation 
      1       0.4574      0.00000
      2      -2.4739      0.00000
      3      -4.0329      0.00000
      4       6.7699      0.00000
      5       6.2752      0.00000
      6     -10.0364      0.00000
      7       2.1108      0.00000
      8      -0.4572      0.00000
      9       4.7175      0.00000
     10      -2.7677      0.00000
     11       5.2819      0.00000
     12      -4.6440      0.00000
     13      -0.1556      0.00000
     14      -4.5642      0.00000
     15      -8.8543      0.00000
     16      -8.7287      0.00000
     17      10.2010      0.00000
     18      11.1562      0.00000
     19       6.7297      0.00000
     20     -11.9253      0.00000

 k-point 130 :      -0.2083    0.2083    0.2083
  band No.  band energies     occupation 
      1       0.0493      0.00000
      2      -1.9758      0.00000
      3      -4.3677      0.00000
      4       6.4649      0.00000
      5       5.0889      0.00000
      6      -4.3830      0.00000
      7      -8.6990      0.00000
      8       6.5486      0.00000
      9      10.0377      0.00000
     10      -8.2680      0.00000
     11       3.0393      0.00000
     12      -2.3886      0.00000
     13       2.4870      0.00000
     14      -7.8208      0.00000
     15      -7.7689      0.00000
     16      -4.4005      0.00000
     17       9.9443      0.00000
     18       7.4990      0.00000
     19       3.5719      0.00000
     20     -12.0095      0.00000

 k-point 131 :       0.2917    0.2917    0.2083
  band No.  band energies     occupation 
      1      -0.0366      0.00000
      2      -3.6020      0.00000
      3      -1.6406      0.00000
      4       6.8610      0.00000
      5      -2.9836      0.00000
      6       5.8718      0.00000
      7      -0.8351      0.00000
      8       2.7698      0.00000
      9      -4.9101      0.00000
     10      -1.0631      0.00000
     11      -7.4727      0.00000
     12       5.4344      0.00000
     13       2.5186      0.00000
     14      -7.1839      0.00000
     15      -2.3646      0.00000
     16      -4.0461      0.00000
     17       3.7780      0.00000
     18       4.0121      0.00000
     19       3.8560      0.00000
     20       2.2706      0.00000

 k-point 132 :       0.3750    0.2917    0.2083
  band No.  band energies     occupation 
      1      -0.0377      0.00000
      2      -4.0279      0.00000
      3      -3.6628      0.00000
      4      10.5657      0.00000
      5      -5.6301      0.00000
      6       3.3759      0.00000
      7       5.5946      0.00000
      8       0.3594      0.00000
      9       0.1785      0.00000
     10      -3.8839      0.00000
     11      -4.6949      0.00000
     12      -1.6393      0.00000
     13      -0.9383      0.00000
     14      -2.2467      0.00000
     15      -4.3387      0.00000
     16       2.6687      0.00000
     17      -1.1613      0.00000
     18       4.1997      0.00000
     19       6.9314      0.00000
     20       0.9082      0.00000

 k-point 133 :       0.4583    0.2917    0.2083
  band No.  band energies     occupation 
      1       0.0150      0.00000
      2      -5.4279      0.00000
      3      -1.1219      0.00000
      4       9.2843      0.00000
      5      -6.3242      0.00000
      6       5.2043      0.00000
      7       6.6173      0.00000
      8      -1.8704      0.00000
      9      -7.1862      0.00000
     10       3.3455      0.00000
     11      -1.8229      0.00000
     12      -5.4727      0.00000
     13      -3.4127      0.00000
     14       1.8274      0.00000
     15      -5.9258      0.00000
     16       5.8030      0.00000
     17      -6.0909      0.00000
     18       1.4526      0.00000
     19      12.4278      0.00000
     20       5.5686      0.00000

 k-point 134 :      -0.4583    0.2917    0.2083
  band No.  band energies     occupation 
      1       0.2417      0.00000
      2      -4.8717      0.00000
      3      -1.2215      0.00000
      4       7.9627      0.00000
      5       6.8069      0.00000
      6      -8.2805      0.00000
      7      -2.2629      0.00000
      8       8.8723      0.00000
      9      -9.5252      0.00000
     10       5.5415      0.00000
     11      -1.3162      0.00000
     12      -3.3309      0.00000
     13      -5.1830      0.00000
     14      -0.8566      0.00000
     15      -4.1660      0.00000
     16       2.7932      0.00000
     17     -12.0133      0.00000
     18      13.3439      0.00000
     19       6.0785      0.00000
     20       4.2982      0.00000

 k-point 135 :      -0.3750    0.2917    0.2083
  band No.  band energies     occupation 
      1       1.2006      0.00000
      2      -3.9351      0.00000
      3      -2.8147      0.00000
      4       6.9674      0.00000
      5       6.7233      0.00000
      6      -8.2857      0.00000
      7      -0.1055      0.00000
      8       4.1656      0.00000
      9      -4.9662      0.00000
     10       6.1694      0.00000
     11      -2.3615      0.00000
     12      -2.2368      0.00000
     13      -1.6197      0.00000
     14      -3.1995      0.00000
     15      -5.7851      0.00000
     16      -1.3948      0.00000
     17      -4.0806      0.00000
     18      -5.4399      0.00000
     19      11.6526      0.00000
     20       3.0276      0.00000

 k-point 136 :      -0.2917    0.2917    0.2083
  band No.  band energies     occupation 
      1       0.9535      0.00000
      2      -2.9489      0.00000
      3      -3.3032      0.00000
      4       6.1007      0.00000
      5       6.3655      0.00000
      6      -8.2999      0.00000
      7       1.3995      0.00000
      8      -3.1540      0.00000
      9       4.7797      0.00000
     10      -0.7113      0.00000
     11       1.3488      0.00000
     12       0.0027      0.00000
     13      -2.5668      0.00000
     14      -4.6301      0.00000
     15      -5.8072      0.00000
     16      -3.8078      0.00000
     17      -0.0136      0.00000
     18       2.5746      0.00000
     19      14.2125      0.00000
     20      -5.5884      0.00000

 k-point 137 :      -0.2083    0.2917    0.2083
  band No.  band energies     occupation 
      1       0.1083      0.00000
      2      -1.6409      0.00000
      3      -2.2739      0.00000
      4       4.1123      0.00000
      5       5.0216      0.00000
      6      -5.3972      0.00000
      7      -0.8228      0.00000
      8      -1.0745      0.00000
      9       7.9209      0.00000
     10      -6.1264      0.00000
     11       1.2162      0.00000
     12       2.4359      0.00000
     13      -1.5211      0.00000
     14      -7.1475      0.00000
     15      -0.6192      0.00000
     16      -4.6670      0.00000
     17       5.3258      0.00000
     18       5.7935      0.00000
     19       0.9360      0.00000
     20       1.5156      0.00000

 k-point 138 :       0.3750    0.3750    0.2083
  band No.  band energies     occupation 
      1       0.0010      0.00000
      2      -3.5343      0.00000
      3      -1.2179      0.00000
      4       5.8244      0.00000
      5      -2.0105      0.00000
      6       6.0273      0.00000
      7       1.3879      0.00000
      8      -0.6131      0.00000
      9      -3.1550      0.00000
     10      -0.6691      0.00000
     11     -10.0300      0.00000
     12       4.5535      0.00000
     13      -1.4690      0.00000
     14       3.4498      0.00000
     15      -6.4193      0.00000
     16       1.9242      0.00000
     17      -1.2224      0.00000
     18       2.7571      0.00000
     19       6.7381      0.00000
     20       2.2035      0.00000

 k-point 139 :       0.4583    0.3750    0.2083
  band No.  band energies     occupation 
      1       0.0664      0.00000
      2      -4.0861      0.00000
      3      -2.5267      0.00000
      4       8.1740      0.00000
      5      -2.8876      0.00000
      6       9.7070      0.00000
      7      -7.4580      0.00000
      8       5.1241      0.00000
      9      -5.4979      0.00000
     10       2.8639      0.00000
     11      -5.3121      0.00000
     12      -3.2142      0.00000
     13       1.3793      0.00000
     14      -5.9514      0.00000
     15       1.5573      0.00000
     16       3.7017      0.00000
     17      -5.0016      0.00000
     18      11.3368      0.00000
     19      -1.6044      0.00000
     20       5.3828      0.00000

 k-point 140 :      -0.4583    0.3750    0.2083
  band No.  band energies     occupation 
      1       0.2832      0.00000
      2      -5.4401      0.00000
      3      -0.8592      0.00000
      4       7.4539      0.00000
      5      -3.8747      0.00000
      6       9.4479      0.00000
      7      -6.7494      0.00000
      8       6.6155      0.00000
      9      -9.6175      0.00000
     10       6.7547      0.00000
     11      -5.1658      0.00000
     12      -0.0706      0.00000
     13      -1.1684      0.00000
     14      -6.5368      0.00000
     15      -2.0139      0.00000
     16       4.5716      0.00000
     17      -7.7173      0.00000
     18      15.8675      0.00000
     19     -12.6890      0.00000
     20      -6.9201      0.00000

 k-point 141 :      -0.3750    0.3750    0.2083
  band No.  band energies     occupation 
      1       1.0020      0.00000
      2      -5.0949      0.00000
      3      -1.4310      0.00000
      4       6.5224      0.00000
      5       8.3748      0.00000
      6      -5.7977      0.00000
      7      -4.3105      0.00000
      8       5.0070      0.00000
      9      -6.9825      0.00000
     10       7.1229      0.00000
     11      -5.5530      0.00000
     12       2.5119      0.00000
     13      -0.6910      0.00000
     14      -4.8319      0.00000
     15      -6.7472      0.00000
     16       2.0819      0.00000
     17      -7.0571      0.00000
     18      11.3592      0.00000
     19      -4.0340      0.00000
     20       2.5871      0.00000

 k-point 142 :      -0.2917    0.3750    0.2083
  band No.  band energies     occupation 
      1       1.7938      0.00000
      2      -3.9181      0.00000
      3      -2.3684      0.00000
      4       5.0384      0.00000
      5       8.0908      0.00000
      6      -9.0521      0.00000
      7       1.4393      0.00000
      8      -1.9194      0.00000
      9       0.6710      0.00000
     10       2.4547      0.00000
     11      -3.4923      0.00000
     12       3.6291      0.00000
     13      -1.2213      0.00000
     14      -6.7337      0.00000
     15      -1.4401      0.00000
     16      -1.2195      0.00000
     17       3.1836      0.00000
     18      -5.9879      0.00000
     19       0.6710      0.00000
     20       6.8221      0.00000

 k-point 143 :      -0.2083    0.3750    0.2083
  band No.  band energies     occupation 
      1       0.1317      0.00000
      2      -0.9128      0.00000
      3      -0.7654      0.00000
      4       1.6974      0.00000
      5       4.8264      0.00000
      6      -5.4025      0.00000
      7       0.3753      0.00000
      8      -1.0690      0.00000
      9       2.3732      0.00000
     10      -1.0741      0.00000
     11      -0.3801      0.00000
     12       2.0620      0.00000
     13      -1.9325      0.00000
     14      -5.7048      0.00000
     15       4.9205      0.00000
     16      -1.4835      0.00000
     17       0.1013      0.00000
     18      -1.7764      0.00000
     19       3.5447      0.00000
     20      -0.0767      0.00000

 k-point 144 :       0.4583    0.4583    0.2083
  band No.  band energies     occupation 
      1       0.1623      0.00000
      2      -3.9609      0.00000
      3       5.0966      0.00000
      4      -0.7560      0.00000
      5      -1.3907      0.00000
      6       2.7544      0.00000
      7       5.2045      0.00000
      8      -2.3883      0.00000
      9      -1.9638      0.00000
     10       0.2591      0.00000
     11      -9.4047      0.00000
     12       2.6989      0.00000
     13      -2.6562      0.00000
     14      -0.1003      0.00000
     15       4.7388      0.00000
     16       0.5310      0.00000
     17      -5.7708      0.00000
     18       7.5301      0.00000
     19      -2.3098      0.00000
     20      -5.1786      0.00000

 k-point 145 :      -0.4583    0.4583    0.2083
  band No.  band energies     occupation 
      1       0.4328      0.00000
      2      -4.6467      0.00000
      3       2.3560      0.00000
      4       2.5851      0.00000
      5      -1.5238      0.00000
      6       3.4409      0.00000
      7      -1.3719      0.00000
      8       4.2378      0.00000
      9      -6.3859      0.00000
     10       4.2165      0.00000
     11      -7.7926      0.00000
     12       2.8851      0.00000
     13      -3.5053      0.00000
     14      -1.2125      0.00000
     15      -0.2427      0.00000
     16       3.6572      0.00000
     17      10.7982      0.00000
     18      -8.8869      0.00000
     19      -4.6906      0.00000
     20       0.2149      0.00000

 k-point 146 :      -0.3750    0.4583    0.2083
  band No.  band energies     occupation 
      1       1.1299      0.00000
      2      -4.8480      0.00000
      3      -0.1518      0.00000
      4       4.3943      0.00000
      5      -2.3085      0.00000
      6       5.0871      0.00000
      7      -3.3786      0.00000
      8       3.6379      0.00000
      9      -7.9413      0.00000
     10       7.1952      0.00000
     11      -7.7819      0.00000
     12       4.9777      0.00000
     13       3.9342      0.00000
     14      -7.7081      0.00000
     15      -2.4849      0.00000
     16      -0.4129      0.00000
     17      -5.5764      0.00000
     18      10.9044      0.00000
     19       6.9306      0.00000
     20     -12.5730      0.00000

 k-point 147 :      -0.2917    0.4583    0.2083
  band No.  band energies     occupation 
      1       2.5541      0.00000
      2      -3.9318      0.00000
      3      -1.3482      0.00000
      4       2.9083      0.00000
      5       1.4198      0.00000
      6       0.5186      0.00000
      7      -4.7191      0.00000
      8       2.9840      0.00000
      9      -3.0299      0.00000
     10       3.6600      0.00000
     11      -4.3000      0.00000
     12       3.7036      0.00000
     13       3.5195      0.00000
     14      -1.6241      0.00000
     15      -6.7810      0.00000
     16      -2.6250      0.00000
     17       1.7383      0.00000
     18       2.2989      0.00000
     19      13.3274      0.00000
     20     -14.4563      0.00000

 k-point 148 :      -0.2083    0.4583    0.2083
  band No.  band energies     occupation 
      1      -0.6158      0.00000
      2       1.6398      0.00000
      3       0.8440      0.00000
      4      -2.0451      0.00000
      5      -8.3294      0.00000
      6       9.1530      0.00000
      7      -0.8993      0.00000
      8       0.6227      0.00000
      9      -0.3160      0.00000
     10      -0.7774      0.00000
     11       1.6895      0.00000
     12      -2.0411      0.00000
     13       0.0048      0.00000
     14       7.8126      0.00000
     15      -5.7691      0.00000
     16       0.9952      0.00000
     17      -0.4900      0.00000
     18       3.0545      0.00000
     19      -2.1098      0.00000
     20      -0.4807      0.00000

 k-point 149 :      -0.4583   -0.4583    0.2083
  band No.  band energies     occupation 
      1       0.7202      0.00000
      2      -4.1033      0.00000
      3       3.8887      0.00000
      4      -0.3169      0.00000
      5      -0.6411      0.00000
      6       1.1320      0.00000
      7       2.9470      0.00000
      8      -1.0334      0.00000
      9      -0.7023      0.00000
     10       0.2168      0.00000
     11      -4.1994      0.00000
     12       0.5417      0.00000
     13      -4.8724      0.00000
     14       4.1527      0.00000
     15       5.9466      0.00000
     16      -5.2439      0.00000
     17       5.4286      0.00000
     18       0.7595      0.00000
     19      -9.7997      0.00000
     20       2.1862      0.00000

 k-point 150 :      -0.3750   -0.4583    0.2083
  band No.  band energies     occupation 
      1       1.4654      0.00000
      2      -2.8392      0.00000
      3       1.2174      0.00000
      4       0.2845      0.00000
      5      -0.3074      0.00000
      6       0.5969      0.00000
      7      -0.6342      0.00000
      8       1.8285      0.00000
      9      -2.0892      0.00000
     10       1.3855      0.00000
     11      -1.7399      0.00000
     12       0.5560      0.00000
     13      -3.2870      0.00000
     14       3.2752      0.00000
     15       6.5137      0.00000
     16      -9.1176      0.00000
     17       1.2846      0.00000
     18       5.1886      0.00000
     19       0.2638      0.00000
     20      -8.3147      0.00000

 k-point 151 :      -0.2917   -0.4583    0.2083
  band No.  band energies     occupation 
      1      -1.9768      0.00000
      2       3.3837      0.00000
      3      -0.0835      0.00000
      4      -1.4918      0.00000
      5       0.8957      0.00000
      6      -1.7316      0.00000
      7       2.0618      0.00000
      8      -2.1477      0.00000
      9       4.6232      0.00000
     10      -4.5410      0.00000
     11       4.1539      0.00000
     12      -3.1267      0.00000
     13      -2.7514      0.00000
     14       1.4521      0.00000
     15      -0.7217      0.00000
     16       8.8250      0.00000
     17      -2.0419      0.00000
     18      -2.4558      0.00000
     19     -10.3005      0.00000
     20      11.2061      0.00000

 k-point 152 :      -0.3750   -0.3750    0.2083
  band No.  band energies     occupation 
      1      -1.2418      0.00000
      2       2.5601      0.00000
      3      -1.4833      0.00000
      4       0.1051      0.00000
      5       0.2169      0.00000
      6      -0.3798      0.00000
      7      -1.0668      0.00000
      8       0.3692      0.00000
      9       0.2311      0.00000
     10      -0.1260      0.00000
     11       1.4338      0.00000
     12      -0.0723      0.00000
     13       2.5146      0.00000
     14      -3.6380      0.00000
     15      -2.8970      0.00000
     16       4.8631      0.00000
     17      -3.5348      0.00000
     18      -2.0751      0.00000
     19       3.5140      0.00000
     20       3.4853      0.00000

 k-point 153 :      -0.2917   -0.3750    0.2083
  band No.  band energies     occupation 
      1      -0.8579      0.00000
      2       4.3975      0.00000
      3      -2.8899      0.00000
      4      -1.0534      0.00000
      5       0.9184      0.00000
      6      -1.8569      0.00000
      7       0.7830      0.00000
      8      -3.6811      0.00000
      9       5.2653      0.00000
     10      -3.4622      0.00000
     11       5.1332      0.00000
     12      -1.9089      0.00000
     13       5.2912      0.00000
     14      -2.4035      0.00000
     15      -1.0762      0.00000
     16      -1.2491      0.00000
     17       1.5497      0.00000
     18      -6.4636      0.00000
     19      10.4083      0.00000
     20      -0.9487      0.00000

 k-point 154 :      -0.2917   -0.2917    0.2083
  band No.  band energies     occupation 
      1      -0.3579      0.00000
      2       4.3022      0.00000
      3      -4.8209      0.00000
      4       0.5331      0.00000
      5       1.0382      0.00000
      6      -1.8971      0.00000
      7      -4.3129      0.00000
      8       1.6644      0.00000
      9       1.3130      0.00000
     10      -0.3326      0.00000
     11       6.8685      0.00000
     12      -1.5625      0.00000
     13       4.4178      0.00000
     14      -2.3494      0.00000
     15      -5.2042      0.00000
     16       0.8119      0.00000
     17      -7.2267      0.00000
     18       8.0860      0.00000
     19       2.2873      0.00000
     20      -0.3387      0.00000

 k-point 155 :       0.2917    0.2917    0.2917
  band No.  band energies     occupation 
      1      -0.0303      0.00000
      2      -2.9933      0.00000
      3      -6.4897      0.00000
      4      10.3020      0.00000
      5     -11.3871      0.00000
      6      13.0424      0.00000
      7       1.4473      0.00000
      8       3.8766      0.00000
      9      -5.2828      0.00000
     10      -9.1173      0.00000
     11       0.0886      0.00000
     12       5.1536      0.00000
     13      -7.7083      0.00000
     14      -0.6195      0.00000
     15      -0.5856      0.00000
     16       6.6757      0.00000
     17      -9.3675      0.00000
     18       5.9026      0.00000
     19       0.0386      0.00000
     20      10.6525      0.00000

 k-point 156 :       0.3750    0.2917    0.2917
  band No.  band energies     occupation 
      1      -0.0252      0.00000
      2      -3.1515      0.00000
      3      -5.0825      0.00000
      4      10.8078      0.00000
      5     -12.8600      0.00000
      6       7.9145      0.00000
      7       7.6810      0.00000
      8       3.2704      0.00000
      9      -6.4126      0.00000
     10       1.2971      0.00000
     11      -6.1968      0.00000
     12      -0.5563      0.00000
     13      -2.7740      0.00000
     14      -3.5197      0.00000
     15       4.2915      0.00000
     16      -2.8710      0.00000
     17      -6.4392      0.00000
     18       7.6044      0.00000
     19       6.4930      0.00000
     20       3.7553      0.00000

 k-point 157 :       0.4583    0.2917    0.2917
  band No.  band energies     occupation 
      1       0.0307      0.00000
      2      -3.5183      0.00000
      3      -3.2520      0.00000
      4       9.6896      0.00000
      5       5.7968      0.00000
      6     -13.0562      0.00000
      7      10.5496      0.00000
      8       1.0440      0.00000
      9      -7.9716      0.00000
     10       2.9741      0.00000
     11      -0.2216      0.00000
     12      -7.3788      0.00000
     13      -0.0469      0.00000
     14      -5.7569      0.00000
     15       4.9088      0.00000
     16      -2.2279      0.00000
     17      -9.9182      0.00000
     18       9.0830      0.00000
     19       4.4012      0.00000
     20      11.3987      0.00000

 k-point 158 :      -0.4583    0.2917    0.2917
  band No.  band energies     occupation 
      1       0.2271      0.00000
      2      -4.6783      0.00000
      3      -1.2949      0.00000
      4       8.2237      0.00000
      5       5.7333      0.00000
      6     -12.9603      0.00000
      7      12.5271      0.00000
      8      -0.7720      0.00000
      9      -9.4326      0.00000
     10       4.8640      0.00000
     11       0.5229      0.00000
     12      -4.6382      0.00000
     13      -6.5547      0.00000
     14       4.3817      0.00000
     15      -2.4875      0.00000
     16      -3.4969      0.00000
     17     -10.0376      0.00000
     18       3.4713      0.00000
     19      13.2927      0.00000
     20      10.0290      0.00000

 k-point 159 :      -0.3750    0.2917    0.2917
  band No.  band energies     occupation 
      1       0.8916      0.00000
      2      -4.4517      0.00000
      3      -1.6855      0.00000
      4       7.0686      0.00000
      5       5.5557      0.00000
      6     -12.5115      0.00000
      7      10.0344      0.00000
      8      -1.7900      0.00000
      9      -4.6802      0.00000
     10       6.3217      0.00000
     11      -1.3165      0.00000
     12      -2.5640      0.00000
     13      -6.8629      0.00000
     14       2.0794      0.00000
     15      -4.7220      0.00000
     16      -3.5400      0.00000
     17      -1.3378      0.00000
     18       0.8379      0.00000
     19      -1.8960      0.00000
     20       5.9897      0.00000

 k-point 160 :      -0.2917    0.2917    0.2917
  band No.  band energies     occupation 
      1       1.8819      0.00000
      2      -3.7988      0.00000
      3      -3.1915      0.00000
      4       6.2827      0.00000
      5       5.3683      0.00000
      6      -3.6242      0.00000
      7     -11.3213      0.00000
      8       3.2551      0.00000
      9       6.9853      0.00000
     10      -4.6742      0.00000
     11       7.0072      0.00000
     12      -2.7526      0.00000
     13      -0.2107      0.00000
     14      -4.8759      0.00000
     15      -6.1976      0.00000
     16      -2.6487      0.00000
     17       3.4153      0.00000
     18      -4.2304      0.00000
     19       1.6718      0.00000
     20       7.0193      0.00000

 k-point 161 :       0.3750    0.3750    0.2917
  band No.  band energies     occupation 
      1       0.0182      0.00000
      2      -2.8137      0.00000
      3      -2.0681      0.00000
      4       5.8889      0.00000
      5      -2.9449      0.00000
      6       7.6909      0.00000
      7      -1.0110      0.00000
      8       4.3387      0.00000
      9      -7.3608      0.00000
     10      -0.6361      0.00000
     11      -9.6334      0.00000
     12       5.5225      0.00000
     13      -2.7543      0.00000
     14       1.1251      0.00000
     15       3.2770      0.00000
     16      -8.5006      0.00000
     17      -2.3430      0.00000
     18       5.5017      0.00000
     19       5.7669      0.00000
     20       6.1739      0.00000

 k-point 162 :       0.4583    0.3750    0.2917
  band No.  band energies     occupation 
      1       0.0991      0.00000
      2      -3.0359      0.00000
      3      -4.3840      0.00000
      4       9.2774      0.00000
      5      -2.2879      0.00000
      6       1.9088      0.00000
      7       3.5378      0.00000
      8       3.0932      0.00000
      9      -7.3268      0.00000
     10       2.7555      0.00000
     11      -1.3501      0.00000
     12      -7.6143      0.00000
     13       0.1666      0.00000
     14       1.8718      0.00000
     15      -7.0700      0.00000
     16       2.8349      0.00000
     17      -6.4746      0.00000
     18       3.6049      0.00000
     19      11.9849      0.00000
     20       6.1752      0.00000

 k-point 163 :      -0.4583    0.3750    0.2917
  band No.  band energies     occupation 
      1       0.3230      0.00000
      2      -3.5082      0.00000
      3      -2.9072      0.00000
      4       8.0365      0.00000
      5       7.2022      0.00000
      6      -8.1154      0.00000
      7       0.7527      0.00000
      8       5.9501      0.00000
      9      -9.1807      0.00000
     10       5.0683      0.00000
     11      -0.9492      0.00000
     12      -5.4749      0.00000
     13      -0.2532      0.00000
     14      -6.4707      0.00000
     15      -0.2878      0.00000
     16       0.6932      0.00000
     17     -12.0419      0.00000
     18      12.2475      0.00000
     19       1.9728      0.00000
     20       7.8733      0.00000

 k-point 164 :      -0.3750    0.3750    0.2917
  band No.  band energies     occupation 
      1       0.9198      0.00000
      2      -4.6199      0.00000
      3      -1.6541      0.00000
      4       6.8821      0.00000
      5       6.3100      0.00000
      6      -9.1166      0.00000
      7      -1.8631      0.00000
      8       7.0708      0.00000
      9      -5.6685      0.00000
     10       6.8716      0.00000
     11      -2.8321      0.00000
     12      -0.8849      0.00000
     13      -5.0929      0.00000
     14      -0.0136      0.00000
     15      -6.7942      0.00000
     16      -0.4756      0.00000
     17      -1.3023      0.00000
     18      -3.4931      0.00000
     19       0.2870      0.00000
     20       6.9155      0.00000

 k-point 165 :      -0.2917    0.3750    0.2917
  band No.  band energies     occupation 
      1       2.5173      0.00000
      2      -4.5568      0.00000
      3      -3.0000      0.00000
      4       6.0677      0.00000
      5       5.6779      0.00000
      6      -7.5529      0.00000
      7      -3.6178      0.00000
      8      -0.1604      0.00000
      9       5.2563      0.00000
     10       2.4691      0.00000
     11      -0.7432      0.00000
     12       0.0209      0.00000
     13      -2.7422      0.00000
     14      -2.6989      0.00000
     15      -2.6452      0.00000
     16      -6.5002      0.00000
     17      10.9069      0.00000
     18      -5.7045      0.00000
     19     -12.8178      0.00000
     20      12.6636      0.00000

 k-point 166 :       0.4583    0.4583    0.2917
  band No.  band energies     occupation 
      1       0.2443      0.00000
      2      -3.0162      0.00000
      3       4.8280      0.00000
      4      -1.4646      0.00000
      5      -1.7117      0.00000
      6       7.0883      0.00000
      7      -0.4150      0.00000
      8       2.5097      0.00000
      9      -6.3102      0.00000
     10       1.6008      0.00000
     11     -10.8185      0.00000
     12       3.4234      0.00000
     13      -2.0621      0.00000
     14       0.0456      0.00000
     15      -3.2305      0.00000
     16       4.0408      0.00000
     17      -5.6435      0.00000
     18       8.6876      0.00000
     19       0.4890      0.00000
     20       8.1257      0.00000

 k-point 167 :      -0.4583    0.4583    0.2917
  band No.  band energies     occupation 
      1       0.5743      0.00000
      2      -3.4924      0.00000
      3      -0.8990      0.00000
      4       4.8214      0.00000
      5      -0.5506      0.00000
      6       3.4262      0.00000
      7      -6.8365      0.00000
      8      10.6615      0.00000
      9      -7.9422      0.00000
     10       4.7257      0.00000
     11      -6.5223      0.00000
     12       0.4311      0.00000
     13      -3.8492      0.00000
     14      -4.8743      0.00000
     15       0.6276      0.00000
     16       3.9695      0.00000
     17      -9.7603      0.00000
     18      -4.1444      0.00000
     19      13.3667      0.00000
     20      13.9375      0.00000

 k-point 168 :      -0.3750    0.4583    0.2917
  band No.  band energies     occupation 
      1       1.2877      0.00000
      2      -4.3355      0.00000
      3      -1.9682      0.00000
      4       5.9308      0.00000
      5       4.9977      0.00000
      6      -3.0011      0.00000
      7      -4.0499      0.00000
      8       6.4264      0.00000
      9      -6.9336      0.00000
     10       5.9081      0.00000
     11      -5.7663      0.00000
     12       2.8248      0.00000
     13      -1.7285      0.00000
     14      -7.1323      0.00000
     15      -1.4548      0.00000
     16      -0.5630      0.00000
     17      -4.5769      0.00000
     18      12.6780      0.00000
     19     -11.2707      0.00000
     20       6.7074      0.00000

 k-point 169 :      -0.2917    0.4583    0.2917
  band No.  band energies     occupation 
      1       2.6288      0.00000
      2      -4.8336      0.00000
      3      -3.0125      0.00000
      4       5.8063      0.00000
      5       7.5161      0.00000
      6     -10.3237      0.00000
      7       2.2774      0.00000
      8      -0.8840      0.00000
      9      -0.2041      0.00000
     10       3.6693      0.00000
     11      -3.7612      0.00000
     12       3.0477      0.00000
     13       0.8265      0.00000
     14      -4.8048      0.00000
     15      -3.0682      0.00000
     16      -6.1987      0.00000
     17       4.6446      0.00000
     18      -0.5451      0.00000
     19      -9.7605      0.00000
     20      16.8247      0.00000

 k-point 170 :      -0.4583   -0.4583    0.2917
  band No.  band energies     occupation 
      1       1.0766      0.00000
      2      -4.0677      0.00000
      3       4.0237      0.00000
      4      -0.8025      0.00000
      5      -0.8639      0.00000
      6       5.2559      0.00000
      7       3.3189      0.00000
      8      -1.8158      0.00000
      9      -3.9914      0.00000
     10       1.7060      0.00000
     11      -6.7845      0.00000
     12       1.7159      0.00000
     13      -4.8729      0.00000
     14       0.2337      0.00000
     15      -1.5121      0.00000
     16       4.9818      0.00000
     17      -2.1851      0.00000
     18       8.6923      0.00000
     19      -9.6337      0.00000
     20       6.4705      0.00000

 k-point 171 :      -0.3750   -0.4583    0.2917
  band No.  band energies     occupation 
      1       1.8087      0.00000
      2      -4.8212      0.00000
      3       2.5212      0.00000
      4       0.8419      0.00000
      5      -0.1455      0.00000
      6       4.2307      0.00000
      7      -3.6501      0.00000
      8       4.8016      0.00000
      9      -6.0197      0.00000
     10       3.0658      0.00000
     11      -4.2926      0.00000
     12       2.8398      0.00000
     13      -5.2286      0.00000
     14      -2.1835      0.00000
     15      -2.9134      0.00000
     16       1.9717      0.00000
     17       3.8951      0.00000
     18       9.6557      0.00000
     19      -7.3345      0.00000
     20      -3.5861      0.00000

 k-point 172 :      -0.3750   -0.3750    0.2917
  band No.  band energies     occupation 
      1       0.9770      0.00000
      2      -3.2265      0.00000
      3       2.4451      0.00000
      4      -0.1587      0.00000
      5      -0.1677      0.00000
      6       0.5102      0.00000
      7       1.3068      0.00000
      8       0.1751      0.00000
      9      -1.1976      0.00000
     10       0.4233      0.00000
     11      -1.5255      0.00000
     12       0.3456      0.00000
     13      -2.2691      0.00000
     14       0.8056      0.00000
     15      -5.1094      0.00000
     16       4.8121      0.00000
     17       2.9990      0.00000
     18       2.9009      0.00000
     19      -1.8550      0.00000
     20      -3.2633      0.00000

 k-point 173 :       0.3750    0.3750    0.3750
  band No.  band energies     occupation 
      1       0.0752      0.00000
      2      -2.5333      0.00000
      3      -6.8579      0.00000
      4       9.8042      0.00000
      5     -11.7764      0.00000
      6      15.3184      0.00000
      7       0.7713      0.00000
      8       5.2013      0.00000
      9      -7.4778      0.00000
     10     -12.3355      0.00000
     11       1.6568      0.00000
     12       5.5189      0.00000
     13      -5.3708      0.00000
     14       2.1285      0.00000
     15      -7.5664      0.00000
     16      -7.0945      0.00000
     17       6.2913      0.00000
     18       6.4766      0.00000
     19       0.2697      0.00000
     20      13.5921      0.00000

 k-point 174 :       0.4583    0.3750    0.3750
  band No.  band energies     occupation 
      1       0.2012      0.00000
      2      -2.7177      0.00000
      3      -5.6370      0.00000
      4       9.7851      0.00000
      5      10.1283      0.00000
      6     -12.4312      0.00000
      7       5.6125      0.00000
      8       5.2044      0.00000
      9      -8.8835      0.00000
     10       2.5614      0.00000
     11       0.8193      0.00000
     12      -9.9511      0.00000
     13      -1.4351      0.00000
     14       2.0386      0.00000
     15      -9.1760      0.00000
     16       5.2345      0.00000
     17      -8.9133      0.00000
     18       7.1507      0.00000
     19       8.0567      0.00000
     20       7.9772      0.00000

 k-point 175 :      -0.4583    0.3750    0.3750
  band No.  band energies     occupation 
      1       0.5026      0.00000
      2      -3.1009      0.00000
      3      -3.9566      0.00000
      4       8.5065      0.00000
      5       6.9991      0.00000
      6     -12.1412      0.00000
      7       6.8579      0.00000
      8       4.7945      0.00000
      9      -9.2398      0.00000
     10       3.9799      0.00000
     11       2.2945      0.00000
     12      -9.5933      0.00000
     13      -0.7948      0.00000
     14       2.0300      0.00000
     15      -9.3621      0.00000
     16       2.2666      0.00000
     17     -12.8258      0.00000
     18       4.8783      0.00000
     19       9.7473      0.00000
     20       8.1354      0.00000

 k-point 176 :      -0.3750    0.3750    0.3750
  band No.  band energies     occupation 
      1       1.1700      0.00000
      2      -3.8150      0.00000
      3      -2.8247      0.00000
      4       7.1688      0.00000
      5       5.8385      0.00000
      6     -11.9905      0.00000
      7       6.6615      0.00000
      8      -0.2694      0.00000
      9      -2.8291      0.00000
     10       5.7982      0.00000
     11      -0.7392      0.00000
     12      -4.5938      0.00000
     13       1.5293      0.00000
     14      -3.7486      0.00000
     15      -8.0277      0.00000
     16      -1.5027      0.00000
     17      -4.7386      0.00000
     18       1.4999      0.00000
     19       3.4612      0.00000
     20       7.5630      0.00000

 k-point 177 :       0.4583    0.4583    0.3750
  band No.  band energies     occupation 
      1       0.4300      0.00000
      2      -2.7898      0.00000
      3       5.2520      0.00000
      4      -2.3524      0.00000
      5      -2.7975      0.00000
      6       8.5282      0.00000
      7      -1.1515      0.00000
      8       5.8904      0.00000
      9      -9.9727      0.00000
     10       1.7712      0.00000
     11       4.0096      0.00000
     12     -11.1056      0.00000
     13      -1.8532      0.00000
     14      -0.3677      0.00000
     15      -5.9134      0.00000
     16       3.4424      0.00000
     17      -5.8696      0.00000
     18       4.4500      0.00000
     19       6.6772      0.00000
     20       5.2208      0.00000

 k-point 178 :      -0.4583    0.4583    0.3750
  band No.  band energies     occupation 
      1       0.9226      0.00000
      2      -3.3247      0.00000
      3      -3.8035      0.00000
      4       7.3442      0.00000
      5       4.8298      0.00000
      6      -4.0740      0.00000
      7       2.2043      0.00000
      8       5.4750      0.00000
      9      -9.3558      0.00000
     10       4.9193      0.00000
     11       0.1093      0.00000
     12      -8.3131      0.00000
     13      -2.7868      0.00000
     14       0.1321      0.00000
     15      -7.0457      0.00000
     16       5.2518      0.00000
     17     -12.4578      0.00000
     18      -1.5928      0.00000
     19      10.3656      0.00000
     20      15.7238      0.00000

 k-point 179 :      -0.3750    0.4583    0.3750
  band No.  band energies     occupation 
      1       1.6868      0.00000
      2      -4.0888      0.00000
      3      -3.3706      0.00000
      4       6.9728      0.00000
      5       7.5857      0.00000
      6      -7.9867      0.00000
      7       1.1416      0.00000
      8       2.2468      0.00000
      9      -4.3746      0.00000
     10       4.8253      0.00000
     11      -1.3565      0.00000
     12      -3.0222      0.00000
     13      -2.4565      0.00000
     14      -1.1388      0.00000
     15      -8.2180      0.00000
     16      -0.8418      0.00000
     17      -8.3650      0.00000
     18       2.2291      0.00000
     19      15.8532      0.00000
     20       0.9506      0.00000

 k-point 180 :      -0.4583   -0.4583    0.3750
  band No.  band energies     occupation 
      1       1.5899      0.00000
      2      -4.0024      0.00000
      3       4.1653      0.00000
      4      -1.5685      0.00000
      5      -1.2658      0.00000
      6       7.1724      0.00000
      7      -1.4565      0.00000
      8       6.1599      0.00000
      9      -9.2776      0.00000
     10       3.7479      0.00000
     11      -8.6130      0.00000
     12       1.6515      0.00000
     13      -3.9180      0.00000
     14      -2.2162      0.00000
     15      -1.9727      0.00000
     16       4.3567      0.00000
     17      -4.3234      0.00000
     18      -5.2346      0.00000
     19       9.5384      0.00000
     20      12.4341      0.00000

 k-point 181 :       0.4583    0.4583    0.4583
  band No.  band energies     occupation 
      1       0.8331      0.00000
      2      -3.0409      0.00000
      3      -7.0643      0.00000
      4       9.6076      0.00000
      5     -11.9607      0.00000
      6      16.2708      0.00000
      7       0.4718      0.00000
      8       5.7753      0.00000
      9     -10.2643      0.00000
     10       7.4002      0.00000
     11     -15.2844      0.00000
     12       3.1099      0.00000
     13      -3.0578      0.00000
     14       0.3460      0.00000
     15      -6.5662      0.00000
     16      -9.7952      0.00000
     17       8.2474      0.00000
     18       4.6766      0.00000
     19      -2.9969      0.00000
     20       7.8323      0.00000

 k-point 182 :      -0.4583    0.4583    0.4583
  band No.  band energies     occupation 
      1       1.5057      0.00000
      2      -3.7273      0.00000
      3      -6.0207      0.00000
      4       9.0822      0.00000
      5      10.9521      0.00000
      6     -11.7652      0.00000
      7       4.4430      0.00000
      8       5.3689      0.00000
      9      -9.5341      0.00000
     10       6.2360      0.00000
     11       3.5779      0.00000
     12     -14.0309      0.00000
     13       0.3115      0.00000
     14      -2.8693      0.00000
     15      -7.3920      0.00000
     16       7.4702      0.00000
     17     -12.2250      0.00000
     18       2.3761      0.00000
     19       8.3734      0.00000
     20      -0.1712      0.00000

 k-point 183 :       0.0000    0.0000   -0.0417
  band No.  band energies     occupation 
      1       0.0015      0.00000
      2       9.5572      0.00000
      3     -15.3985      0.00000
      4       5.3122      0.00000
      5      -4.8609      0.00000
      6      13.5754      0.00000
      7      -8.2894      0.00000
      8      -0.0894      0.00000
      9       0.1141      0.00000
     10      -0.3505      0.00000
     11       3.2975      0.00000
     12      -5.9957      0.00000
     13      -2.5914      0.00000
     14       6.0232      0.00000
     15      -0.2987      0.00000
     16       9.8975      0.00000
     17     -14.9392      0.00000
     18       5.1048      0.00000
     19      -0.8997      0.00000
     20      10.3127      0.00000

 k-point 184 :       0.0417    0.1250    0.0417
  band No.  band energies     occupation 
      1       0.0044      0.00000
      2       6.2104      0.00000
      3      -7.1201      0.00000
      4       0.3657      0.00000
      5      -0.7178      0.00000
      6       4.5222      0.00000
      7      -3.5756      0.00000
      8      -0.2831      0.00000
      9       0.3945      0.00000
     10       0.7272      0.00000
     11       1.2222      0.00000
     12      -3.8221      0.00000
     13       2.8993      0.00000
     14      -0.3508      0.00000
     15      -0.4649      0.00000
     16       5.9637      0.00000
     17      -5.6077      0.00000
     18       0.2918      0.00000
     19       0.6916      0.00000
     20       1.6054      0.00000

 k-point 185 :       0.0000    0.0833   -0.0417
  band No.  band energies     occupation 
      1       0.0132      0.00000
      2       8.8793      0.00000
      3       3.2880      0.00000
      4     -14.9917      0.00000
      5      13.6373      0.00000
      6     -12.8766      0.00000
      7       1.1364      0.00000
      8      -0.7717      0.00000
      9       0.9608      0.00000
     10       3.0731      0.00000
     11       0.3985      0.00000
     12      -2.7013      0.00000
     13      -3.5941      0.00000
     14       5.8303      0.00000
     15      -2.2038      0.00000
     16      12.2099      0.00000
     17       2.4449      0.00000
     18     -14.1359      0.00000
     19       5.0312      0.00000
     20       6.5952      0.00000

 k-point 186 :       0.0833    0.0000   -0.0417
  band No.  band energies     occupation 
      1      -0.0044      0.00000
      2      -6.2104      0.00000
      3       7.1201      0.00000
      4      -0.3657      0.00000
      5       0.7178      0.00000
      6      -4.5222      0.00000
      7       3.5756      0.00000
      8       0.2831      0.00000
      9      -0.3945      0.00000
     10      -0.7272      0.00000
     11      -1.2222      0.00000
     12       3.8221      0.00000
     13      -2.8993      0.00000
     14       0.3508      0.00000
     15       0.4649      0.00000
     16      -5.9636      0.00000
     17       5.6077      0.00000
     18      -0.2920      0.00000
     19      -0.6916      0.00000
     20      -1.6054      0.00000

 k-point 187 :       0.0417    0.2083    0.0417
  band No.  band energies     occupation 
      1       0.0192      0.00000
      2       4.3904      0.00000
      3      -6.3681      0.00000
      4       1.2982      0.00000
      5      -3.0471      0.00000
      6       6.1041      0.00000
      7      -3.8905      0.00000
      8      -1.3304      0.00000
      9       2.1161      0.00000
     10       2.7103      0.00000
     11       0.9521      0.00000
     12      -3.2134      0.00000
     13       2.3272      0.00000
     14      -0.7596      0.00000
     15      -0.5791      0.00000
     16      -2.9188      0.00000
     17       4.1074      0.00000
     18       1.2882      0.00000
     19      -3.1164      0.00000
     20       0.5667      0.00000

 k-point 188 :       0.0000    0.1667   -0.0417
  band No.  band energies     occupation 
      1       0.0320      0.00000
      2       5.1225      0.00000
      3       4.9390      0.00000
      4     -12.9467      0.00000
      5      12.5914      0.00000
      6     -13.1661      0.00000
      7       1.0175      0.00000
      8      -1.9395      0.00000
      9       2.5578      0.00000
     10       1.8205      0.00000
     11       5.1618      0.00000
     12      -4.6756      0.00000
     13      -2.3994      0.00000
     14       6.2382      0.00000
     15      -3.6648      0.00000
     16      10.2999      0.00000
     17       3.2616      0.00000
     18     -11.4684      0.00000
     19       1.7943      0.00000
     20      -0.2680      0.00000

 k-point 189 :       0.1667    0.0000   -0.0417
  band No.  band energies     occupation 
      1      -0.0192      0.00000
      2      -4.3904      0.00000
      3       6.3681      0.00000
      4      -1.2982      0.00000
      5       3.0471      0.00000
      6      -6.1040      0.00000
      7       3.8905      0.00000
      8       1.3304      0.00000
      9      -2.1161      0.00000
     10      -2.7103      0.00000
     11      -0.9521      0.00000
     12       3.2134      0.00000
     13      -2.3272      0.00000
     14       0.7596      0.00000
     15       0.5791      0.00000
     16       2.9188      0.00000
     17      -4.1074      0.00000
     18      -1.2882      0.00000
     19       3.1164      0.00000
     20      -0.5667      0.00000

 k-point 190 :       0.0417    0.2917    0.0417
  band No.  band energies     occupation 
      1       0.0293      0.00000
      2       3.1843      0.00000
      3      -5.6319      0.00000
      4       2.0539      0.00000
      5      -5.7423      0.00000
      6       5.3788      0.00000
      7      -2.3296      0.00000
      8      -2.8289      0.00000
      9       4.3814      0.00000
     10       5.1565      0.00000
     11      -0.1176      0.00000
     12      -2.7170      0.00000
     13       2.5189      0.00000
     14       0.7017      0.00000
     15      -2.7975      0.00000
     16       0.6087      0.00000
     17       9.6406      0.00000
     18      -5.2957      0.00000
     19      -7.5854      0.00000
     20      -1.7035      0.00000

 k-point 191 :      -0.0000    0.2500   -0.0417
  band No.  band energies     occupation 
      1       0.0427      0.00000
      2       3.5276      0.00000
      3       5.6417      0.00000
      4     -11.3555      0.00000
      5      12.2947      0.00000
      6     -13.4285      0.00000
      7      -0.7524      0.00000
      8      -3.3404      0.00000
      9       4.6682      0.00000
     10       0.1771      0.00000
     11       9.8007      0.00000
     12      -5.7466      0.00000
     13      -1.0937      0.00000
     14       7.3402      0.00000
     15       5.3149      0.00000
     16      -7.9354      0.00000
     17       7.5666      0.00000
     18      -6.8148      0.00000
     19      -0.2645      0.00000
     20      -6.4011      0.00000

 k-point 192 :       0.2500    0.0000   -0.0417
  band No.  band energies     occupation 
      1      -0.0293      0.00000
      2      -3.1843      0.00000
      3       5.6319      0.00000
      4      -2.0539      0.00000
      5       5.7423      0.00000
      6      -5.3788      0.00000
      7       2.3296      0.00000
      8       2.8289      0.00000
      9      -4.3814      0.00000
     10      -5.1565      0.00000
     11       0.1176      0.00000
     12       2.7170      0.00000
     13      -2.5189      0.00000
     14      -0.7017      0.00000
     15       2.7976      0.00000
     16      -0.6087      0.00000
     17      -9.6406      0.00000
     18       5.2957      0.00000
     19       7.5856      0.00000
     20       1.7034      0.00000

 k-point 193 :       0.0417    0.3750    0.0417
  band No.  band energies     occupation 
      1      -0.0191      0.00000
      2       2.5821      0.00000
      3      -5.2764      0.00000
      4       2.5353      0.00000
      5      -7.8245      0.00000
      6       4.1599      0.00000
      7      -0.4760      0.00000
      8      -4.3866      0.00000
      9       6.5429      0.00000
     10       7.3818      0.00000
     11      -2.3413      0.00000
     12      -1.1527      0.00000
     13      -0.2756      0.00000
     14       4.2131      0.00000
     15       3.6161      0.00000
     16       6.1007      0.00000
     17      -2.8959      0.00000
     18      -5.0336      0.00000
     19      -3.0550      0.00000
     20     -10.4790      0.00000

 k-point 194 :       0.0000    0.3333   -0.0417
  band No.  band energies     occupation 
      1      -0.0109      0.00000
      2       2.7466      0.00000
      3       6.1913      0.00000
      4     -10.3583      0.00000
      5      12.3225      0.00000
      6     -13.5864      0.00000
      7      -2.2176      0.00000
      8      -4.8760      0.00000
      9       7.0835      0.00000
     10      -1.3705      0.00000
     11      11.1258      0.00000
     12      -3.9383      0.00000
     13       4.4831      0.00000
     14      -3.0988      0.00000
     15       6.7314      0.00000
     16      -2.9596      0.00000
     17       6.7321      0.00000
     18      -7.2071      0.00000
     19     -10.4540      0.00000
     20      -2.1600      0.00000

 k-point 195 :       0.3333    0.0000   -0.0417
  band No.  band energies     occupation 
      1       0.0191      0.00000
      2      -2.5821      0.00000
      3       5.2764      0.00000
      4      -2.5353      0.00000
      5       7.8245      0.00000
      6      -4.1599      0.00000
      7       0.4760      0.00000
      8       4.3866      0.00000
      9      -6.5429      0.00000
     10      -7.3818      0.00000
     11       2.3413      0.00000
     12       1.1527      0.00000
     13       0.2756      0.00000
     14      -4.2131      0.00000
     15      -3.6161      0.00000
     16      -6.1007      0.00000
     17       2.8959      0.00000
     18       5.0336      0.00000
     19       3.0553      0.00000
     20      10.4787      0.00000

 k-point 196 :       0.0417    0.4583    0.0417
  band No.  band energies     occupation 
      1      -0.4114      0.00000
      2       2.6616      0.00000
      3      -5.1917      0.00000
      4       2.7673      0.00000
      5      -8.8718      0.00000
      6       3.9622      0.00000
      7       0.1380      0.00000
      8      -5.5241      0.00000
      9       9.3199      0.00000
     10       9.3023      0.00000
     11      -7.2519      0.00000
     12       1.9406      0.00000
     13       0.7323      0.00000
     14       3.2912      0.00000
     15       6.0300      0.00000
     16       3.9901      0.00000
     17      -3.5157      0.00000
     18      -6.8583      0.00000
     19      -1.1248      0.00000
     20      -9.8416      0.00000

 k-point 197 :       0.0000    0.4167   -0.0417
  band No.  band energies     occupation 
      1      -0.4160      0.00000
      2       2.7306      0.00000
      3       6.5952      0.00000
      4      -9.7434      0.00000
      5      12.1779      0.00000
      6     -14.3076      0.00000
      7      -2.0907      0.00000
      8      -5.8211      0.00000
      9       9.4668      0.00000
     10      -2.6986      0.00000
     11      -3.3949      0.00000
     12      12.3222      0.00000
     13       2.4692      0.00000
     14      -1.1104      0.00000
     15       7.8229      0.00000
     16      -6.5711      0.00000
     17       9.1469      0.00000
     18      -6.1536      0.00000
     19      -8.5701      0.00000
     20      -2.7486      0.00000

 k-point 198 :       0.4167    0.0000   -0.0417
  band No.  band energies     occupation 
      1       0.4114      0.00000
      2      -2.6616      0.00000
      3       5.1918      0.00000
      4      -2.7673      0.00000
      5       8.8718      0.00000
      6      -3.9622      0.00000
      7      -0.1380      0.00000
      8       5.5241      0.00000
      9      -9.3199      0.00000
     10      -9.3023      0.00000
     11       7.2519      0.00000
     12      -1.9406      0.00000
     13      -0.7323      0.00000
     14      -3.2912      0.00000
     15      -6.0300      0.00000
     16      -3.9901      0.00000
     17       3.5157      0.00000
     18       6.8583      0.00000
     19       1.1247      0.00000
     20       9.8416      0.00000

 k-point 199 :       0.0417   -0.4583    0.0417
  band No.  band energies     occupation 
      1      -1.4873      0.00000
      2       3.6839      0.00000
      3      -5.3061      0.00000
      4       2.7822      0.00000
      5       4.0040      0.00000
      6      -9.1123      0.00000
      7       0.3014      0.00000
      8      -5.9880      0.00000
      9      11.0646      0.00000
     10      -7.3046      0.00000
     11       0.6276      0.00000
     12      11.0714      0.00000
     13       1.8891      0.00000
     14       0.7942      0.00000
     15       6.0825      0.00000
     16      -4.1804      0.00000
     17       6.4645      0.00000
     18      -1.8831      0.00000
     19       0.3795      0.00000
     20       1.4065      0.00000

 k-point 200 :       0.0000   -0.5000   -0.0417
  band No.  band energies     occupation 
      1      -1.4794      0.00000
      2       3.6574      0.00000
      3       6.8224      0.00000
      4      -9.3748      0.00000
      5     -14.3014      0.00000
      6      11.8266      0.00000
      7      -2.0743      0.00000
      8      -5.5538      0.00000
      9      10.3930      0.00000
     10      -8.0617      0.00000
     11      15.4016      0.00000
     12      -3.5156      0.00000
     13       0.0283      0.00000
     14       3.1782      0.00000
     15       6.5394      0.00000
     16      10.8191      0.00000
     17     -10.4769      0.00000
     18      -3.1420      0.00000
     19       5.1911      0.00000
     20      -7.0584      0.00000

 k-point 201 :      -0.5000    0.0000   -0.0417
  band No.  band energies     occupation 
      1       1.4873      0.00000
      2      -3.6839      0.00000
      3       5.3061      0.00000
      4      -2.7822      0.00000
      5      -4.0040      0.00000
      6       9.1123      0.00000
      7      -0.3014      0.00000
      8       5.9880      0.00000
      9     -11.0646      0.00000
     10       7.3046      0.00000
     11      -0.6276      0.00000
     12     -11.0714      0.00000
     13      -1.8891      0.00000
     14      -0.7942      0.00000
     15      -6.0825      0.00000
     16       4.1804      0.00000
     17      -6.4645      0.00000
     18       1.8831      0.00000
     19      -0.3795      0.00000
     20      -1.4065      0.00000

 k-point 202 :       0.0417   -0.3750    0.0417
  band No.  band energies     occupation 
      1      -0.1929      0.00000
      2       2.5836      0.00000
      3       2.6094      0.00000
      4      -5.6195      0.00000
      5       4.0471      0.00000
      6      -8.7370      0.00000
      7       0.2724      0.00000
      8      -5.6807      0.00000
      9       8.8563      0.00000
     10       1.2364      0.00000
     11      -5.9301      0.00000
     12      10.2012      0.00000
     13       2.5653      0.00000
     14      -0.0960      0.00000
     15       7.3124      0.00000
     16      -3.1262      0.00000
     17       4.6426      0.00000
     18      -7.0973      0.00000
     19      -8.3108      0.00000
     20      -4.7657      0.00000

 k-point 203 :       0.0000   -0.4167   -0.0417
  band No.  band energies     occupation 
      1      -0.1918      0.00000
      2       2.4766      0.00000
      3      -9.2105      0.00000
      4       6.8436      0.00000
      5     -13.2565      0.00000
      6      11.3011      0.00000
      7      -2.5781      0.00000
      8      -4.3530      0.00000
      9       7.2644      0.00000
     10       4.2432      0.00000
     11       1.7372      0.00000
     12      -2.2591      0.00000
     13      -1.2549      0.00000
     14       5.8803      0.00000
     15       6.4382      0.00000
     16       7.5883      0.00000
     17      -8.4323      0.00000
     18      -5.8678      0.00000
     19       2.0762      0.00000
     20     -16.0037      0.00000

 k-point 204 :      -0.4167    0.0000   -0.0417
  band No.  band energies     occupation 
      1       0.1929      0.00000
      2      -2.5836      0.00000
      3      -2.6094      0.00000
      4       5.6195      0.00000
      5      -4.0471      0.00000
      6       8.7370      0.00000
      7      -0.2724      0.00000
      8       5.6807      0.00000
      9      -8.8563      0.00000
     10      -1.2364      0.00000
     11       5.9301      0.00000
     12     -10.2012      0.00000
     13      -2.5653      0.00000
     14       0.0960      0.00000
     15      -7.3124      0.00000
     16       3.1262      0.00000
     17      -4.6426      0.00000
     18       7.0973      0.00000
     19       8.3108      0.00000
     20       4.7657      0.00000

 k-point 205 :       0.0417   -0.2917    0.0417
  band No.  band energies     occupation 
      1       0.0177      0.00000
      2       2.8669      0.00000
      3       2.2625      0.00000
      4      -6.1945      0.00000
      5       4.0283      0.00000
      6      -7.5300      0.00000
      7       0.1284      0.00000
      8      -4.4915      0.00000
      9       6.4700      0.00000
     10       2.0715      0.00000
     11       8.2817      0.00000
     12      -5.7956      0.00000
     13       3.7650      0.00000
     14      -1.0021      0.00000
     15      -3.3236      0.00000
     16       9.8783      0.00000
     17       1.7272      0.00000
     18      -5.9796      0.00000
     19      -4.0614      0.00000
     20      -7.3059      0.00000

 k-point 206 :       0.0000   -0.3333   -0.0417
  band No.  band energies     occupation 
      1       0.0090      0.00000
      2       2.6504      0.00000
      3      -9.3107      0.00000
      4       6.6777      0.00000
      5     -10.7214      0.00000
      6      10.6027      0.00000
      7      -3.7471      0.00000
      8      -2.7916      0.00000
      9       4.4842      0.00000
     10       5.9075      0.00000
     11      -0.5226      0.00000
     12      -2.0950      0.00000
     13      -3.0748      0.00000
     14       7.4788      0.00000
     15       5.8198      0.00000
     16       0.8201      0.00000
     17      -0.8286      0.00000
     18      -3.8197      0.00000
     19     -13.5136      0.00000
     20       0.1558      0.00000

 k-point 207 :      -0.3333    0.0000   -0.0417
  band No.  band energies     occupation 
      1      -0.0177      0.00000
      2      -2.8669      0.00000
      3      -2.2625      0.00000
      4       6.1945      0.00000
      5      -4.0284      0.00000
      6       7.5300      0.00000
      7      -0.1284      0.00000
      8       4.4915      0.00000
      9      -6.4700      0.00000
     10      -2.0715      0.00000
     11      -8.2817      0.00000
     12       5.7956      0.00000
     13      -3.7650      0.00000
     14       1.0021      0.00000
     15       3.3236      0.00000
     16      -9.8783      0.00000
     17      -1.7272      0.00000
     18       5.9796      0.00000
     19       4.0619      0.00000
     20       7.3053      0.00000

 k-point 208 :       0.0417   -0.2083    0.0417
  band No.  band energies     occupation 
      1       0.0364      0.00000
      2       3.7830      0.00000
      3       1.7516      0.00000
      4      -7.1415      0.00000
      5       4.1097      0.00000
      6      -5.3589      0.00000
      7      -0.2723      0.00000
      8      -2.8099      0.00000
      9       3.6627      0.00000
     10       2.6439      0.00000
     11       6.0050      0.00000
     12      -5.4694      0.00000
     13      -1.8668      0.00000
     14       5.5521      0.00000
     15       2.2396      0.00000
     16       3.8811      0.00000
     17      -4.0081      0.00000
     18      -1.8212      0.00000
     19      -2.0441      0.00000
     20      -3.1281      0.00000

 k-point 209 :       0.0000   -0.2500   -0.0417
  band No.  band energies     occupation 
      1       0.0257      0.00000
      2       3.3898      0.00000
      3      -9.8234      0.00000
      4       6.3030      0.00000
      5      -6.9018      0.00000
      6       9.9451      0.00000
      7      -5.3396      0.00000
      8      -1.6526      0.00000
      9       4.0449      0.00000
     10       2.1417      0.00000
     11       1.1800      0.00000
     12      -3.0428      0.00000
     13       6.4983      0.00000
     14      -5.8483      0.00000
     15      -7.6788      0.00000
     16      11.7138      0.00000
     17      -5.3358      0.00000
     18       6.1226      0.00000
     19      -8.7621      0.00000
     20       0.6314      0.00000

 k-point 210 :      -0.2500   -0.0000   -0.0417
  band No.  band energies     occupation 
      1      -0.0364      0.00000
      2      -3.7830      0.00000
      3      -1.7516      0.00000
      4       7.1415      0.00000
      5      -4.1097      0.00000
      6       5.3589      0.00000
      7       0.2723      0.00000
      8       2.8099      0.00000
      9      -3.6627      0.00000
     10      -2.6439      0.00000
     11      -6.0050      0.00000
     12       5.4694      0.00000
     13       1.8668      0.00000
     14      -5.5521      0.00000
     15      -2.2396      0.00000
     16      -3.8811      0.00000
     17       4.0081      0.00000
     18       1.8212      0.00000
     19       2.0441      0.00000
     20       3.1280      0.00000

 k-point 211 :       0.0417   -0.1250    0.0417
  band No.  band energies     occupation 
      1       0.0204      0.00000
      2       5.5067      0.00000
      3       1.0815      0.00000
      4      -8.6076      0.00000
      5       4.5140      0.00000
      6      -2.7813      0.00000
      7      -1.2152      0.00000
      8      -1.3047      0.00000
      9       1.6690      0.00000
     10       2.0656      0.00000
     11       3.6144      0.00000
     12      -4.6319      0.00000
     13      -1.7932      0.00000
     14       4.2837      0.00000
     15      -2.1518      0.00000
     16       8.4288      0.00000
     17       1.3566      0.00000
     18      -7.9050      0.00000
     19       0.7833      0.00000
     20       1.9409      0.00000

 k-point 212 :       0.0000   -0.1667   -0.0417
  band No.  band energies     occupation 
      1       0.0123      0.00000
      2       4.8906      0.00000
      3     -11.0185      0.00000
      4       5.7854      0.00000
      5      -3.3338      0.00000
      6       9.9950      0.00000
      7      -7.2756      0.00000
      8      -0.7382      0.00000
      9       1.5425      0.00000
     10       0.9242      0.00000
     11       2.6154      0.00000
     12      -4.5633      0.00000
     13       5.9631      0.00000
     14      -4.3831      0.00000
     15      -0.1266      0.00000
     16       8.1020      0.00000
     17     -11.4502      0.00000
     18       5.3135      0.00000
     19      -3.0197      0.00000
     20       1.2014      0.00000

 k-point 213 :      -0.1667    0.0000   -0.0417
  band No.  band energies     occupation 
      1      -0.0204      0.00000
      2      -5.5067      0.00000
      3      -1.0815      0.00000
      4       8.6076      0.00000
      5      -4.5140      0.00000
      6       2.7813      0.00000
      7       1.2152      0.00000
      8       1.3047      0.00000
      9      -1.6690      0.00000
     10      -2.0656      0.00000
     11      -3.6144      0.00000
     12       4.6319      0.00000
     13       1.7932      0.00000
     14      -4.2837      0.00000
     15       2.1518      0.00000
     16      -8.4288      0.00000
     17      -1.3566      0.00000
     18       7.9049      0.00000
     19      -0.7833      0.00000
     20      -1.9409      0.00000

 k-point 214 :       0.0417   -0.0417    0.0417
  band No.  band energies     occupation 
      1       0.0045      0.00000
      2       8.2416      0.00000
      3       0.3152      0.00000
      4      -9.7308      0.00000
      5       3.5636      0.00000
      6      -0.6590      0.00000
      7      -2.0417      0.00000
      8      -0.2640      0.00000
      9       0.3307      0.00000
     10       1.0525      0.00000
     11       1.6752      0.00000
     12      -3.3627      0.00000
     13      -1.3080      0.00000
     14       2.9654      0.00000
     15      -0.7589      0.00000
     16       6.2841      0.00000
     17       0.2784      0.00000
     18      -6.4030      0.00000
     19       3.6883      0.00000
     20       6.5708      0.00000

 k-point 215 :       0.0000   -0.0833   -0.0417
  band No.  band energies     occupation 
      1       0.0015      0.00000
      2       8.3506      0.00000
      3     -13.1613      0.00000
      4       4.6142      0.00000
      5      -0.7474      0.00000
      6      11.4599      0.00000
      7     -10.6253      0.00000
      8      -0.0884      0.00000
      9       0.1311      0.00000
     10       0.1554      0.00000
     11       3.0425      0.00000
     12      -7.6292      0.00000
     13       6.1633      0.00000
     14      -1.5315      0.00000
     15      -0.1266      0.00000
     16      12.4915      0.00000
     17     -14.1034      0.00000
     18       1.7534      0.00000
     19       3.7134      0.00000
     20      -2.8007      0.00000

 k-point 216 :      -0.0833   -0.0000   -0.0417
  band No.  band energies     occupation 
      1      -0.0045      0.00000
      2      -8.2416      0.00000
      3      -0.3152      0.00000
      4       9.7308      0.00000
      5      -3.5636      0.00000
      6       0.6590      0.00000
      7       2.0417      0.00000
      8       0.2640      0.00000
      9      -0.3307      0.00000
     10      -1.0525      0.00000
     11      -1.6752      0.00000
     12       3.3627      0.00000
     13       1.3080      0.00000
     14      -2.9654      0.00000
     15       0.7589      0.00000
     16      -6.2841      0.00000
     17      -0.2781      0.00000
     18       6.4027      0.00000
     19      -3.6883      0.00000
     20      -6.5708      0.00000

 k-point 217 :       0.0417    0.1250    0.1250
  band No.  band energies     occupation 
      1      -0.0014      0.00000
      2      -7.1930      0.00000
      3      10.7722      0.00000
      4      -3.5706      0.00000
      5       0.3732      0.00000
      6      -9.3048      0.00000
      7       9.0315      0.00000
      8       0.0739      0.00000
      9      -0.2125      0.00000
     10      -0.0125      0.00000
     11      -2.5582      0.00000
     12       7.4819      0.00000
     13      -6.4098      0.00000
     14       1.5250      0.00000
     15      -0.0157      0.00000
     16     -11.5990      0.00000
     17      12.6706      0.00000
     18      -1.3472      0.00000
     19       0.6056      0.00000
     20       0.9840      0.00000

 k-point 218 :       0.0833    0.0833   -0.0417
  band No.  band energies     occupation 
      1       0.0071      0.00000
      2       7.0118      0.00000
      3       0.3701      0.00000
      4      -8.6395      0.00000
      5       1.9926      0.00000
      6      -0.9412      0.00000
      7      -0.2955      0.00000
      8      -0.4160      0.00000
      9       0.5218      0.00000
     10       0.6563      0.00000
     11       2.7459      0.00000
     12      -2.7565      0.00000
     13      -2.1421      0.00000
     14       2.7362      0.00000
     15      -0.8028      0.00000
     16       5.3402      0.00000
     17       0.4790      0.00000
     18      -5.4913      0.00000
     19       1.8174      0.00000
     20       5.2179      0.00000

 k-point 219 :       0.0000   -0.0833   -0.1250
  band No.  band energies     occupation 
      1       0.0014      0.00000
      2       7.1930      0.00000
      3     -10.7722      0.00000
      4       3.5706      0.00000
      5      -0.3732      0.00000
      6       9.3048      0.00000
      7      -9.0315      0.00000
      8      -0.0739      0.00000
      9       0.2125      0.00000
     10       0.0125      0.00000
     11       2.5582      0.00000
     12      -7.4819      0.00000
     13       6.4098      0.00000
     14      -1.5250      0.00000
     15       0.0157      0.00000
     16      11.5991      0.00000
     17     -12.6706      0.00000
     18       1.3471      0.00000
     19      -0.6056      0.00000
     20      -0.9840      0.00000

 k-point 220 :       0.0417    0.2083    0.1250
  band No.  band energies     occupation 
      1       0.0039      0.00000
      2       4.2100      0.00000
      3      -6.0862      0.00000
      4       1.9645      0.00000
      5      -0.8475      0.00000
      6       8.0368      0.00000
      7      -7.6125      0.00000
      8      -0.0719      0.00000
      9       7.8818      0.00000
     10      -7.4086      0.00000
     11       0.8481      0.00000
     12      -3.4429      0.00000
     13       4.1799      0.00000
     14      -1.7166      0.00000
     15       0.2950      0.00000
     16      -3.0324      0.00000
     17       2.4820      0.00000
     18       1.4783      0.00000
     19      -2.0779      0.00000
     20       1.0859      0.00000

 k-point 221 :       0.1250    0.0417    0.2083
  band No.  band energies     occupation 
      1       0.0090      0.00000
      2       4.6079      0.00000
      3      -3.5612      0.00000
      4      -1.7315      0.00000
      5       0.7944      0.00000
      6      -1.9158      0.00000
      7       1.1373      0.00000
      8      -0.5514      0.00000
      9      -0.4124      0.00000
     10       1.7658      0.00000
     11       1.2521      0.00000
     12      -1.2318      0.00000
     13      -0.6722      0.00000
     14       1.2840      0.00000
     15      -0.5886      0.00000
     16      -0.4670      0.00000
     17       3.8101      0.00000
     18      -2.6873      0.00000
     19      -0.7158      0.00000
     20       2.3836      0.00000

 k-point 222 :       0.0833    0.1667   -0.0417
  band No.  band energies     occupation 
      1       0.0269      0.00000
      2       7.6631      0.00000
      3       2.0930      0.00000
      4     -12.7441      0.00000
      5       4.4706      0.00000
      6      -2.5412      0.00000
      7      -1.0015      0.00000
      8      -1.1978      0.00000
      9       0.9886      0.00000
     10       2.0206      0.00000
     11       4.3387      0.00000
     12      -2.8460      0.00000
     13      -3.2997      0.00000
     14       4.6110      0.00000
     15      -2.2384      0.00000
     16       7.2261      0.00000
     17       2.8702      0.00000
     18      -8.9407      0.00000
     19      -0.3216      0.00000
     20       5.1455      0.00000

 k-point 223 :       0.0833   -0.0833   -0.1250
  band No.  band energies     occupation 
      1      -0.0039      0.00000
      2      -4.2100      0.00000
      3       6.0862      0.00000
      4      -1.9645      0.00000
      5       0.8475      0.00000
      6      -8.0368      0.00000
      7       7.6125      0.00000
      8       0.0719      0.00000
      9      -7.8818      0.00000
     10       7.4086      0.00000
     11      -0.8481      0.00000
     12       3.4429      0.00000
     13      -4.1799      0.00000
     14       1.7166      0.00000
     15      -0.2950      0.00000
     16       3.0325      0.00000
     17      -2.4820      0.00000
     18      -1.4783      0.00000
     19       2.0779      0.00000
     20      -1.0859      0.00000

 k-point 224 :      -0.1667   -0.0833   -0.2083
  band No.  band energies     occupation 
      1      -0.0090      0.00000
      2      -4.6079      0.00000
      3       3.5611      0.00000
      4       1.7315      0.00000
      5      -0.7944      0.00000
      6       1.9158      0.00000
      7      -1.1373      0.00000
      8       0.5514      0.00000
      9       0.4124      0.00000
     10      -1.7658      0.00000
     11      -1.2521      0.00000
     12       1.2318      0.00000
     13       0.6722      0.00000
     14      -1.2840      0.00000
     15       0.5886      0.00000
     16       0.4670      0.00000
     17      -3.8102      0.00000
     18       2.6873      0.00000
     19       0.7158      0.00000
     20      -2.3836      0.00000

 k-point 225 :       0.0417    0.2917    0.1250
  band No.  band energies     occupation 
      1       0.0136      0.00000
      2       3.1087      0.00000
      3      -5.9652      0.00000
      4       3.1478      0.00000
      5      -3.6219      0.00000
      6       1.8714      0.00000
      7      -0.1217      0.00000
      8       0.2862      0.00000
      9       0.3239      0.00000
     10       1.3380      0.00000
     11       0.2395      0.00000
     12      -1.0064      0.00000
     13       3.9809      0.00000
     14      -3.2440      0.00000
     15      -5.6913      0.00000
     16       5.9291      0.00000
     17       7.8375      0.00000
     18      -3.9301      0.00000
     19      -7.3215      0.00000
     20       1.4477      0.00000

 k-point 226 :       0.1250    0.0417    0.2917
  band No.  band energies     occupation 
      1       0.0251      0.00000
      2       3.8804      0.00000
      3      -3.6369      0.00000
      4      -1.1015      0.00000
      5       1.0202      0.00000
      6      -3.3082      0.00000
      7       0.9364      0.00000
      8      -2.0296      0.00000
      9       1.6506      0.00000
     10       3.2491      0.00000
     11       1.9731      0.00000
     12      -1.5033      0.00000
     13      -1.7208      0.00000
     14       4.0346      0.00000
     15       0.3952      0.00000
     16       5.8751      0.00000
     17      -3.9915      0.00000
     18      -2.4310      0.00000
     19      -3.3727      0.00000
     20       0.2198      0.00000

 k-point 227 :       0.0833    0.2500   -0.0417
  band No.  band energies     occupation 
      1       0.0433      0.00000
      2       4.5375      0.00000
      3       3.9484      0.00000
      4     -11.2745      0.00000
      5       4.8024      0.00000
      6      -0.9144      0.00000
      7      -5.1626      0.00000
      8      -1.5105      0.00000
      9       0.1104      0.00000
     10       3.9210      0.00000
     11       6.6068      0.00000
     12      -3.3715      0.00000
     13      -1.7440      0.00000
     14       5.3333      0.00000
     15       4.0787      0.00000
     16       4.9419      0.00000
     17      -7.0735      0.00000
     18      -3.6643      0.00000
     19      -3.4676      0.00000
     20       0.8490      0.00000

 k-point 228 :       0.1667   -0.0833   -0.1250
  band No.  band energies     occupation 
      1      -0.0136      0.00000
      2      -3.1087      0.00000
      3       5.9652      0.00000
      4      -3.1478      0.00000
      5       3.6219      0.00000
      6      -1.8715      0.00000
      7       0.1218      0.00000
      8      -0.2862      0.00000
      9      -0.3239      0.00000
     10      -1.3380      0.00000
     11      -0.2395      0.00000
     12       1.0064      0.00000
     13      -3.9809      0.00000
     14       3.2440      0.00000
     15       5.6914      0.00000
     16      -5.9291      0.00000
     17      -7.8375      0.00000
     18       3.9301      0.00000
     19       7.3215      0.00000
     20      -1.4477      0.00000

 k-point 229 :      -0.2500   -0.1667   -0.2917
  band No.  band energies     occupation 
      1      -0.0251      0.00000
      2      -3.8804      0.00000
      3       3.6369      0.00000
      4       1.1015      0.00000
      5      -1.0202      0.00000
      6       3.3083      0.00000
      7      -0.9364      0.00000
      8       2.0296      0.00000
      9      -1.6506      0.00000
     10      -3.2491      0.00000
     11      -1.9731      0.00000
     12       1.5033      0.00000
     13       1.7208      0.00000
     14      -4.0346      0.00000
     15      -0.3952      0.00000
     16      -5.8751      0.00000
     17       3.9915      0.00000
     18       2.4310      0.00000
     19       3.3727      0.00000
     20      -0.2198      0.00000

 k-point 230 :       0.0417    0.3750    0.1250
  band No.  band energies     occupation 
      1      -0.0036      0.00000
      2       2.4928      0.00000
      3      -5.0794      0.00000
      4       2.8458      0.00000
      5      -7.1488      0.00000
      6       5.1080      0.00000
      7      -1.2042      0.00000
      8       0.6334      0.00000
      9      -3.3668      0.00000
     10       6.6514      0.00000
     11      -1.2891      0.00000
     12       0.6988      0.00000
     13      -3.2792      0.00000
     14       5.2428      0.00000
     15       6.9363      0.00000
     16       6.7184      0.00000
     17      -7.4364      0.00000
     18      -2.0331      0.00000
     19     -12.2931      0.00000
     20       1.6992      0.00000

 k-point 231 :       0.1250    0.0417    0.3750
  band No.  band energies     occupation 
      1       0.0056      0.00000
      2       3.0030      0.00000
      3      -4.3056      0.00000
      4       0.7948      0.00000
      5       1.7194      0.00000
      6      -6.4878      0.00000
      7       1.5636      0.00000
      8      -3.7278      0.00000
      9       6.5395      0.00000
     10       2.1007      0.00000
     11       1.1826      0.00000
     12      -0.3116      0.00000
     13       2.4485      0.00000
     14      -1.3246      0.00000
     15       0.4125      0.00000
     16       6.4390      0.00000
     17      -1.1193      0.00000
     18      -3.8795      0.00000
     19      -4.8902      0.00000
     20      -4.1637      0.00000

 k-point 232 :       0.0833    0.3333   -0.0417
  band No.  band energies     occupation 
      1       0.0180      0.00000
      2       3.2382      0.00000
      3       4.9087      0.00000
      4     -10.1563      0.00000
      5       4.1125      0.00000
      6      -3.1312      0.00000
      7      -4.1593      0.00000
      8      -2.5008      0.00000
      9       5.5351      0.00000
     10      -0.7168      0.00000
     11       6.5315      0.00000
     12      -0.3147      0.00000
     13       1.9178      0.00000
     14       1.7483      0.00000
     15      -3.2501      0.00000
     16       4.5360      0.00000
     17       2.5903      0.00000
     18      -4.8257      0.00000
     19      -6.6158      0.00000
     20      -3.6644      0.00000

 k-point 233 :       0.2500   -0.0833   -0.1250
  band No.  band energies     occupation 
      1       0.0036      0.00000
      2      -2.4928      0.00000
      3       5.0794      0.00000
      4      -2.8458      0.00000
      5       7.1488      0.00000
      6      -5.1080      0.00000
      7       1.2042      0.00000
      8      -0.6334      0.00000
      9       3.3668      0.00000
     10      -6.6514      0.00000
     11       1.2891      0.00000
     12      -0.6988      0.00000
     13       3.2792      0.00000
     14      -5.2428      0.00000
     15      -6.9363      0.00000
     16      -6.7184      0.00000
     17       7.4364      0.00000
     18       2.0331      0.00000
     19      12.2931      0.00000
     20      -1.6992      0.00000

 k-point 234 :      -0.3333   -0.2500   -0.3750
  band No.  band energies     occupation 
      1      -0.0056      0.00000
      2      -3.0030      0.00000
      3       4.3056      0.00000
      4      -0.7948      0.00000
      5      -1.7194      0.00000
      6       6.4878      0.00000
      7      -1.5636      0.00000
      8       3.7278      0.00000
      9      -6.5395      0.00000
     10      -2.1007      0.00000
     11      -1.1826      0.00000
     12       0.3116      0.00000
     13      -2.4485      0.00000
     14       1.3246      0.00000
     15      -0.4125      0.00000
     16      -6.4390      0.00000
     17       1.1193      0.00000
     18       3.8795      0.00000
     19       4.8903      0.00000
     20       4.1637      0.00000

 k-point 235 :       0.0417    0.4583    0.1250
  band No.  band energies     occupation 
      1      -0.2027      0.00000
      2       2.4201      0.00000
      3      -2.3169      0.00000
      4       0.0092      0.00000
      5      -9.6965      0.00000
      6       8.2917      0.00000
      7      -2.2452      0.00000
      8      -1.0385      0.00000
      9       2.5574      0.00000
     10       2.1687      0.00000
     11       0.5424      0.00000
     12      -0.1818      0.00000
     13      -0.4524      0.00000
     14       6.7580      0.00000
     15       6.5086      0.00000
     16       6.3088      0.00000
     17     -10.9254      0.00000
     18      -4.6878      0.00000
     19     -15.8352      0.00000
     20       4.3900      0.00000

 k-point 236 :       0.1250    0.0417    0.4583
  band No.  band energies     occupation 
      1      -0.2116      0.00000
      2       2.7010      0.00000
      3      -6.9012      0.00000
      4       4.2059      0.00000
      5       3.8191      0.00000
      6     -10.5381      0.00000
      7       2.1394      0.00000
      8      -5.5071      0.00000
      9       9.0246      0.00000
     10       1.8297      0.00000
     11      -0.3215      0.00000
     12       2.9022      0.00000
     13       2.5594      0.00000
     14       0.8305      0.00000
     15       3.2653      0.00000
     16      -0.4326      0.00000
     17       2.3524      0.00000
     18      -6.1338      0.00000
     19      -3.1935      0.00000
     20      -7.0755      0.00000

 k-point 237 :       0.0833    0.4167   -0.0417
  band No.  band energies     occupation 
      1      -0.2128      0.00000
      2       2.7859      0.00000
      3       5.2417      0.00000
      4      -9.0515      0.00000
      5       1.8904      0.00000
      6      -3.1227      0.00000
      7      -2.5871      0.00000
      8      -4.6912      0.00000
      9       8.5584      0.00000
     10      -2.5840      0.00000
     11      -0.5742      0.00000
     12       9.3053      0.00000
     13       1.1449      0.00000
     14      -1.0627      0.00000
     15       7.9496      0.00000
     16      -5.2587      0.00000
     17       6.9761      0.00000
     18      -4.2480      0.00000
     19     -10.7137      0.00000
     20      -5.9014      0.00000

 k-point 238 :       0.3333   -0.0833   -0.1250
  band No.  band energies     occupation 
      1       0.2027      0.00000
      2      -2.4201      0.00000
      3       2.3169      0.00000
      4      -0.0092      0.00000
      5       9.6965      0.00000
      6      -8.2917      0.00000
      7       2.2452      0.00000
      8       1.0385      0.00000
      9      -2.5574      0.00000
     10      -2.1687      0.00000
     11      -0.5424      0.00000
     12       0.1818      0.00000
     13       0.4524      0.00000
     14      -6.7580      0.00000
     15      -6.5086      0.00000
     16      -6.3088      0.00000
     17      10.9254      0.00000
     18       4.6878      0.00000
     19      15.8352      0.00000
     20      -4.3900      0.00000

 k-point 239 :      -0.4167   -0.3333   -0.4583
  band No.  band energies     occupation 
      1       0.2116      0.00000
      2      -2.7010      0.00000
      3       6.9012      0.00000
      4      -4.2059      0.00000
      5      -3.8191      0.00000
      6      10.5381      0.00000
      7      -2.1394      0.00000
      8       5.5071      0.00000
      9      -9.0246      0.00000
     10      -1.8297      0.00000
     11       0.3215      0.00000
     12      -2.9022      0.00000
     13      -2.5594      0.00000
     14      -0.8305      0.00000
     15      -3.2653      0.00000
     16       0.4326      0.00000
     17      -2.3524      0.00000
     18       6.1338      0.00000
     19       3.1935      0.00000
     20       7.0755      0.00000

 k-point 240 :       0.0417   -0.4583    0.1250
  band No.  band energies     occupation 
      1      -1.5018      0.00000
      2       3.7030      0.00000
      3       3.9337      0.00000
      4      -6.8260      0.00000
      5     -10.3459      0.00000
      6       9.9816      0.00000
      7      -3.0091      0.00000
      8      -4.4042      0.00000
      9       7.9012      0.00000
     10      -5.2734      0.00000
     11       0.8376      0.00000
     12       6.8604      0.00000
     13       0.9141      0.00000
     14       3.9325      0.00000
     15       6.8572      0.00000
     16       7.2846      0.00000
     17      -4.8836      0.00000
     18      -7.6928      0.00000
     19     -16.4989      0.00000
     20       2.0442      0.00000

 k-point 241 :       0.1250    0.0417   -0.4583
  band No.  band energies     occupation 
      1      -1.5276      0.00000
      2       3.8077      0.00000
      3      -8.2785      0.00000
      4       5.9936      0.00000
      5       7.1646      0.00000
      6     -14.7193      0.00000
      7       2.4759      0.00000
      8      -7.0622      0.00000
      9      11.2411      0.00000
     10      -4.1782      0.00000
     11      11.5119      0.00000
     12      -3.1864      0.00000
     13       1.7238      0.00000
     14       2.6678      0.00000
     15       2.7950      0.00000
     16       2.8699      0.00000
     17      -1.3939      0.00000
     18       2.8541      0.00000
     19      -7.3239      0.00000
     20     -13.2675      0.00000

 k-point 242 :       0.0833   -0.5000   -0.0417
  band No.  band energies     occupation 
      1      -1.5284      0.00000
      2       3.7932      0.00000
      3       0.5573      0.00000
      4      -3.3986      0.00000
      5      -2.2123      0.00000
      6      -0.2987      0.00000
      7      -1.5869      0.00000
      8      -5.8816      0.00000
      9      10.0325      0.00000
     10      -5.7117      0.00000
     11       4.6276      0.00000
     12       4.3320      0.00000
     13       3.2597      0.00000
     14       0.8501      0.00000
     15       5.7515      0.00000
     16      -6.8911      0.00000
     17      10.4684      0.00000
     18      -0.0334      0.00000
     19      -4.8249      0.00000
     20     -17.9712      0.00000

 k-point 243 :      -0.5833   -0.0833   -0.1250
  band No.  band energies     occupation 
      1       1.5018      0.00000
      2      -3.7030      0.00000
      3      -3.9337      0.00000
      4       6.8260      0.00000
      5      10.3459      0.00000
      6      -9.9816      0.00000
      7       3.0091      0.00000
      8       4.4042      0.00000
      9      -7.9012      0.00000
     10       5.2734      0.00000
     11      -0.8376      0.00000
     12      -6.8604      0.00000
     13      -0.9141      0.00000
     14      -3.9325      0.00000
     15      -6.8572      0.00000
     16      -7.2846      0.00000
     17       4.8836      0.00000
     18       7.6928      0.00000
     19      16.4989      0.00000
     20      -2.0442      0.00000

 k-point 244 :       0.5000    0.5833    0.4583
  band No.  band energies     occupation 
      1       1.5276      0.00000
      2      -3.8077      0.00000
      3       8.2785      0.00000
      4      -5.9936      0.00000
      5      -7.1646      0.00000
      6      14.7193      0.00000
      7      -2.4759      0.00000
      8       7.0622      0.00000
      9     -11.2411      0.00000
     10       4.1782      0.00000
     11     -11.5119      0.00000
     12       3.1864      0.00000
     13      -1.7238      0.00000
     14      -2.6678      0.00000
     15      -2.7950      0.00000
     16      -2.8699      0.00000
     17       1.3939      0.00000
     18      -2.8541      0.00000
     19       7.3239      0.00000
     20      13.2675      0.00000

 k-point 245 :       0.0417   -0.3750    0.1250
  band No.  band energies     occupation 
      1      -0.4473      0.00000
      2       2.8890      0.00000
      3       5.1824      0.00000
      4      -9.0992      0.00000
      5      -6.6691      0.00000
      6       7.7604      0.00000
      7      -4.1772      0.00000
      8      -5.3448      0.00000
      9       9.4094      0.00000
     10      -3.5097      0.00000
     11      -2.5615      0.00000
     12      11.7527      0.00000
     13       1.0388      0.00000
     14      -1.1450      0.00000
     15       8.5305      0.00000
     16      -5.2791      0.00000
     17      10.8403      0.00000
     18      -2.5053      0.00000
     19      -9.5886      0.00000
     20      -7.7245      0.00000

 k-point 246 :       0.1250    0.0417   -0.3750
  band No.  band energies     occupation 
      1      -0.4331      0.00000
      2       2.7685      0.00000
      3      -5.8590      0.00000
      4       3.6001      0.00000
      5      11.5727      0.00000
      6     -18.9253      0.00000
      7       2.6008      0.00000
      8      -6.6117      0.00000
      9      10.3375      0.00000
     10       5.6829      0.00000
     11      -4.1024      0.00000
     12       1.5610      0.00000
     13       2.6325      0.00000
     14       2.5535      0.00000
     15       3.1172      0.00000
     16       1.2028      0.00000
     17      -1.2498      0.00000
     18      -6.0227      0.00000
     19       4.5006      0.00000
     20     -11.3554      0.00000

 k-point 247 :       0.0833   -0.4167   -0.0417
  band No.  band energies     occupation 
      1      -0.4231      0.00000
      2       2.6520      0.00000
      3      -2.9841      0.00000
      4       0.6775      0.00000
      5     -10.0849      0.00000
      6       6.8907      0.00000
      7      -0.9749      0.00000
      8      -3.9539      0.00000
      9       6.9598      0.00000
     10       4.2521      0.00000
     11      -2.1648      0.00000
     12      -0.4402      0.00000
     13       1.1799      0.00000
     14       5.5047      0.00000
     15       5.3687      0.00000
     16       3.9685      0.00000
     17      -8.2724      0.00000
     18      -4.6197      0.00000
     19      -8.3157      0.00000
     20      -1.8283      0.00000

 k-point 248 :      -0.5000   -0.0833   -0.1250
  band No.  band energies     occupation 
      1       0.4473      0.00000
      2      -2.8890      0.00000
      3      -5.1824      0.00000
      4       9.0992      0.00000
      5       6.6691      0.00000
      6      -7.7604      0.00000
      7       4.1772      0.00000
      8       5.3448      0.00000
      9      -9.4094      0.00000
     10       3.5097      0.00000
     11       2.5615      0.00000
     12     -11.7527      0.00000
     13      -1.0388      0.00000
     14       1.1450      0.00000
     15      -8.5305      0.00000
     16       5.2791      0.00000
     17     -10.8403      0.00000
     18       2.5053      0.00000
     19       9.5886      0.00000
     20       7.7245      0.00000

 k-point 249 :       0.4167    0.5000    0.3750
  band No.  band energies     occupation 
      1       0.4331      0.00000
      2      -2.7685      0.00000
      3       5.8590      0.00000
      4      -3.6001      0.00000
      5     -11.5727      0.00000
      6      18.9253      0.00000
      7      -2.6008      0.00000
      8       6.6117      0.00000
      9     -10.3375      0.00000
     10      -5.6829      0.00000
     11       4.1024      0.00000
     12      -1.5610      0.00000
     13      -2.6325      0.00000
     14      -2.5535      0.00000
     15      -3.1172      0.00000
     16      -1.2028      0.00000
     17       1.2498      0.00000
     18       6.0227      0.00000
     19      -4.5006      0.00000
     20      11.3554      0.00000

 k-point 250 :       0.0417   -0.2917    0.1250
  band No.  band energies     occupation 
      1      -0.0146      0.00000
      2       3.0435      0.00000
      3       4.7675      0.00000
      4     -10.1830      0.00000
      5       5.7989      0.00000
      6      -2.4747      0.00000
      7      -6.3539      0.00000
      8      -3.0943      0.00000
      9       6.8248      0.00000
     10      -1.7212      0.00000
     11       2.9978      0.00000
     12       4.9568      0.00000
     13       0.9018      0.00000
     14      -0.8576      0.00000
     15       3.4928      0.00000
     16       0.0479      0.00000
     17       6.4355      0.00000
     18      -6.8523      0.00000
     19      -7.2527      0.00000
     20      -5.9674      0.00000

 k-point 251 :       0.1250    0.0417   -0.2917
  band No.  band energies     occupation 
      1      -0.0303      0.00000
      2       2.6924      0.00000
      3      -4.7405      0.00000
      4       2.1059      0.00000
      5       3.8846      0.00000
      6      -9.9420      0.00000
      7       2.4502      0.00000
      8      -4.7382      0.00000
      9       8.2551      0.00000
     10       4.2968      0.00000
     11      -3.9532      0.00000
     12       1.2327      0.00000
     13       1.9327      0.00000
     14       1.5811      0.00000
     15       2.3337      0.00000
     16       2.8792      0.00000
     17      -0.6929      0.00000
     18      -4.2285      0.00000
     19      -0.2421      0.00000
     20      -9.8387      0.00000

 k-point 252 :       0.0833   -0.3333   -0.0417
  band No.  band energies     occupation 
      1      -0.0322      0.00000
      2       2.4757      0.00000
      3      -4.0162      0.00000
      4       1.7958      0.00000
      5     -11.0329      0.00000
      6       7.7786      0.00000
      7      -0.3760      0.00000
      8      -1.4804      0.00000
      9       1.0707      0.00000
     10       7.2088      0.00000
     11      -3.7307      0.00000
     12       0.7999      0.00000
     13      -1.3220      0.00000
     14       5.6255      0.00000
     15       4.9359      0.00000
     16       4.3994      0.00000
     17      -5.8086      0.00000
     18      -2.3430      0.00000
     19      -6.7704      0.00000
     20      -4.8238      0.00000

 k-point 253 :      -0.4167   -0.0833   -0.1250
  band No.  band energies     occupation 
      1       0.0146      0.00000
      2      -3.0435      0.00000
      3      -4.7675      0.00000
      4      10.1830      0.00000
      5      -5.7989      0.00000
      6       2.4747      0.00000
      7       6.3539      0.00000
      8       3.0943      0.00000
      9      -6.8248      0.00000
     10       1.7212      0.00000
     11      -2.9978      0.00000
     12      -4.9568      0.00000
     13      -0.9018      0.00000
     14       0.8577      0.00000
     15      -3.4929      0.00000
     16      -0.0479      0.00000
     17      -6.4355      0.00000
     18       6.8523      0.00000
     19       7.2527      0.00000
     20       5.9674      0.00000

 k-point 254 :       0.3333    0.4167    0.2917
  band No.  band energies     occupation 
      1       0.0303      0.00000
      2      -2.6924      0.00000
      3       4.7405      0.00000
      4      -2.1059      0.00000
      5      -3.8846      0.00000
      6       9.9420      0.00000
      7      -2.4502      0.00000
      8       4.7382      0.00000
      9      -8.2551      0.00000
     10      -4.2968      0.00000
     11       3.9532      0.00000
     12      -1.2327      0.00000
     13      -1.9327      0.00000
     14      -1.5811      0.00000
     15      -2.3337      0.00000
     16      -2.8792      0.00000
     17       0.6929      0.00000
     18       4.2285      0.00000
     19       0.2421      0.00000
     20       9.8387      0.00000

 k-point 255 :       0.0417   -0.2083    0.1250
  band No.  band energies     occupation 
      1       0.0504      0.00000
      2       4.1859      0.00000
      3       3.9505      0.00000
      4     -11.5451      0.00000
      5       9.0176      0.00000
      6      -2.4685      0.00000
      7      -8.5112      0.00000
      8      -1.4239      0.00000
      9      -0.5826      0.00000
     10       4.8554      0.00000
     11       5.4434      0.00000
     12      -0.5882      0.00000
     13       0.4513      0.00000
     14       3.9492      0.00000
     15       6.7338      0.00000
     16       3.9329      0.00000
     17      -7.1231      0.00000
     18      -5.6790      0.00000
     19      -3.7072      0.00000
     20      -0.7670      0.00000

 k-point 256 :       0.1250    0.0417   -0.2083
  band No.  band energies     occupation 
      1       0.0189      0.00000
      2       3.2730      0.00000
      3      -4.4189      0.00000
      4       0.9828      0.00000
      5      -0.4705      0.00000
      6      -3.2999      0.00000
      7       1.8231      0.00000
      8      -2.6063      0.00000
      9       4.3883      0.00000
     10       2.9577      0.00000
     11      -1.7646      0.00000
     12       0.0979      0.00000
     13      -0.4490      0.00000
     14       1.3374      0.00000
     15       2.6639      0.00000
     16       6.5851      0.00000
     17      -4.6923      0.00000
     18      -2.3304      0.00000
     19      -3.3519      0.00000
     20      -2.5973      0.00000

 k-point 257 :       0.0833   -0.2500   -0.0417
  band No.  band energies     occupation 
      1       0.0141      0.00000
      2       2.9385      0.00000
      3      -4.4932      0.00000
      4       1.7931      0.00000
      5      -5.2440      0.00000
      6       3.1220      0.00000
      7      -0.1022      0.00000
      8      -0.5909      0.00000
      9      -0.1333      0.00000
     10       4.6224      0.00000
     11      -1.7500      0.00000
     12       0.0220      0.00000
     13       1.7331      0.00000
     14      -2.0673      0.00000
     15      -0.2476      0.00000
     16       3.6262      0.00000
     17       3.5911      0.00000
     18      -1.8661      0.00000
     19      -8.3414      0.00000
     20       0.6267      0.00000

 k-point 258 :      -0.3333   -0.0833   -0.1250
  band No.  band energies     occupation 
      1      -0.0504      0.00000
      2      -4.1859      0.00000
      3      -3.9505      0.00000
      4      11.5451      0.00000
      5      -9.0176      0.00000
      6       2.4685      0.00000
      7       8.5112      0.00000
      8       1.4239      0.00000
      9       0.5826      0.00000
     10      -4.8554      0.00000
     11      -5.4434      0.00000
     12       0.5882      0.00000
     13      -0.4513      0.00000
     14      -3.9492      0.00000
     15      -6.7337      0.00000
     16      -3.9328      0.00000
     17       7.1231      0.00000
     18       5.6790      0.00000
     19       3.7072      0.00000
     20       0.7670      0.00000

 k-point 259 :       0.2500    0.3333    0.2083
  band No.  band energies     occupation 
      1      -0.0189      0.00000
      2      -3.2730      0.00000
      3       4.4189      0.00000
      4      -0.9828      0.00000
      5       0.4705      0.00000
      6       3.2999      0.00000
      7      -1.8231      0.00000
      8       2.6063      0.00000
      9      -4.3883      0.00000
     10      -2.9577      0.00000
     11       1.7646      0.00000
     12      -0.0979      0.00000
     13       0.4490      0.00000
     14      -1.3374      0.00000
     15      -2.6639      0.00000
     16      -6.5851      0.00000
     17       4.6923      0.00000
     18       2.3304      0.00000
     19       3.3519      0.00000
     20       2.5973      0.00000

 k-point 260 :       0.0417   -0.1250    0.1250
  band No.  band energies     occupation 
      1       0.0421      0.00000
      2       7.3641      0.00000
      3       1.7416      0.00000
      4     -13.2538      0.00000
      5       9.1810      0.00000
      6      -6.6834      0.00000
      7      -1.7952      0.00000
      8      -1.5375      0.00000
      9       1.0279      0.00000
     10       3.0864      0.00000
     11       4.0908      0.00000
     12      -1.7862      0.00000
     13      -1.7172      0.00000
     14       5.4153      0.00000
     15      -4.3973      0.00000
     16       8.1824      0.00000
     17       4.4355      0.00000
     18     -10.9314      0.00000
     19      -0.1188      0.00000
     20       4.0585      0.00000

 k-point 261 :       0.1250    0.0417   -0.1250
  band No.  band energies     occupation 
      1       0.0083      0.00000
      2       3.7355      0.00000
      3      -4.0222      0.00000
      4       0.0329      0.00000
      5      -0.1226      0.00000
      6      -0.6228      0.00000
      7       0.3571      0.00000
      8      -0.6675      0.00000
      9      -0.3783      0.00000
     10       2.3746      0.00000
     11      -0.0726      0.00000
     12      -0.6279      0.00000
     13       0.1840      0.00000
     14       0.5463      0.00000
     15       0.4787      0.00000
     16      -1.9065      0.00000
     17       3.0358      0.00000
     18      -1.0053      0.00000
     19      -1.2719      0.00000
     20       0.5216      0.00000

 k-point 262 :       0.0833   -0.1667   -0.0417
  band No.  band energies     occupation 
      1       0.0060      0.00000
      2       3.4690      0.00000
      3      -4.3439      0.00000
      4       0.9334      0.00000
      5      -1.3879      0.00000
      6       7.2545      0.00000
      7      -6.4493      0.00000
      8      -0.2477      0.00000
      9       3.9094      0.00000
     10      -2.7052      0.00000
     11      -0.0318      0.00000
     12      -1.4934      0.00000
     13       1.9701      0.00000
     14      -0.8811      0.00000
     15       1.3690      0.00000
     16      -2.9847      0.00000
     17       1.8340      0.00000
     18       1.4072      0.00000
     19      -2.3027      0.00000
     20       0.3628      0.00000

 k-point 263 :      -0.2500   -0.0833   -0.1250
  band No.  band energies     occupation 
      1      -0.0421      0.00000
      2      -7.3641      0.00000
      3      -1.7416      0.00000
      4      13.2538      0.00000
      5      -9.1810      0.00000
      6       6.6835      0.00000
      7       1.7951      0.00000
      8       1.5375      0.00000
      9      -1.0279      0.00000
     10      -3.0864      0.00000
     11      -4.0908      0.00000
     12       1.7862      0.00000
     13       1.7172      0.00000
     14      -5.4153      0.00000
     15       4.3973      0.00000
     16      -8.1824      0.00000
     17      -4.4355      0.00000
     18      10.9314      0.00000
     19       0.1188      0.00000
     20      -4.0585      0.00000

 k-point 264 :       0.1667    0.2500    0.1250
  band No.  band energies     occupation 
      1      -0.0083      0.00000
      2      -3.7355      0.00000
      3       4.0222      0.00000
      4      -0.0329      0.00000
      5       0.1226      0.00000
      6       0.6228      0.00000
      7      -0.3571      0.00000
      8       0.6675      0.00000
      9       0.3783      0.00000
     10      -2.3746      0.00000
     11       0.0726      0.00000
     12       0.6279      0.00000
     13      -0.1840      0.00000
     14      -0.5463      0.00000
     15      -0.4787      0.00000
     16       1.9065      0.00000
     17      -3.0358      0.00000
     18       1.0053      0.00000
     19       1.2719      0.00000
     20      -0.5216      0.00000

 k-point 265 :       0.0417   -0.0417    0.1250
  band No.  band energies     occupation 
      1       0.0209      0.00000
      2       8.2428      0.00000
      3       2.5225      0.00000
      4     -14.0334      0.00000
      5       7.3935      0.00000
      6      -7.1057      0.00000
      7       1.4663      0.00000
      8      -1.1686      0.00000
      9       1.5126      0.00000
     10       1.8114      0.00000
     11       2.6529      0.00000
     12      -2.5747      0.00000
     13      -3.2982      0.00000
     14       5.3708      0.00000
     15      -2.6390      0.00000
     16      11.0242      0.00000
     17       1.6100      0.00000
     18     -11.7319      0.00000
     19       2.9358      0.00000
     20       5.6401      0.00000

 k-point 266 :       0.1250    0.0417   -0.0417
  band No.  band energies     occupation 
      1      -0.0070      0.00000
      2      -5.1640      0.00000
      3       4.4561      0.00000
      4       1.4061      0.00000
      5      -0.8402      0.00000
      6      -0.7743      0.00000
      7       1.4250      0.00000
      8       0.4475      0.00000
      9      -0.5619      0.00000
     10      -0.8072      0.00000
     11      -0.9316      0.00000
     12       2.1227      0.00000
     13      -0.6679      0.00000
     14      -0.8326      0.00000
     15       0.6465      0.00000
     16      -0.5370      0.00000
     17      -2.7783      0.00000
     18       2.7561      0.00000
     19       0.0946      0.00000
     20      -2.2462      0.00000

 k-point 267 :       0.0833   -0.0833   -0.0417
  band No.  band energies     occupation 
      1      -0.0042      0.00000
      2      -5.1062      0.00000
      3       7.0626      0.00000
      4      -1.8892      0.00000
      5       1.0968      0.00000
      6      -3.9338      0.00000
      7       3.0966      0.00000
      8       0.2266      0.00000
      9      -0.5652      0.00000
     10      -0.1985      0.00000
     11      -1.0378      0.00000
     12       3.6470      0.00000
     13      -3.8505      0.00000
     14       1.3843      0.00000
     15      -0.0244      0.00000
     16      -0.3415      0.00000
     17       1.9290      0.00000
     18      -2.1156      0.00000
     19       1.2203      0.00000
     20      -0.4490      0.00000

 k-point 268 :      -0.1667   -0.0833   -0.1250
  band No.  band energies     occupation 
      1      -0.0209      0.00000
      2      -8.2428      0.00000
      3      -2.5225      0.00000
      4      14.0334      0.00000
      5      -7.3935      0.00000
      6       7.1057      0.00000
      7      -1.4663      0.00000
      8       1.1686      0.00000
      9      -1.5126      0.00000
     10      -1.8114      0.00000
     11      -2.6529      0.00000
     12       2.5747      0.00000
     13       3.2982      0.00000
     14      -5.3708      0.00000
     15       2.6390      0.00000
     16     -11.0241      0.00000
     17      -1.6100      0.00000
     18      11.7318      0.00000
     19      -2.9358      0.00000
     20      -5.6401      0.00000

 k-point 269 :       0.0833    0.1667    0.0417
  band No.  band energies     occupation 
      1       0.0070      0.00000
      2       5.1640      0.00000
      3      -4.4561      0.00000
      4      -1.4061      0.00000
      5       0.8402      0.00000
      6       0.7743      0.00000
      7      -1.4250      0.00000
      8      -0.4475      0.00000
      9       0.5619      0.00000
     10       0.8072      0.00000
     11       0.9316      0.00000
     12      -2.1227      0.00000
     13       0.6679      0.00000
     14       0.8326      0.00000
     15      -0.6465      0.00000
     16       0.5370      0.00000
     17       2.7784      0.00000
     18      -2.7562      0.00000
     19      -0.0946      0.00000
     20       2.2462      0.00000

 k-point 270 :       0.0417    0.2083    0.2083
  band No.  band energies     occupation 
      1      -0.0012      0.00000
      2      -4.8026      0.00000
      3       7.7244      0.00000
      4      -2.9708      0.00000
      5       0.2644      0.00000
      6       6.9616      0.00000
      7      -7.0614      0.00000
      8      -0.0669      0.00000
      9      -0.0511      0.00000
     10       0.0241      0.00000
     11      -1.2648      0.00000
     12       6.2740      0.00000
     13      -6.6670      0.00000
     14       1.6461      0.00000
     15       9.1608      0.00000
     16      -9.0620      0.00000
     17      -0.6523      0.00000
     18       0.1178      0.00000
     19       0.7237      0.00000
     20      -5.1407      0.00000

 k-point 271 :       0.1667    0.1667   -0.0417
  band No.  band energies     occupation 
      1       0.0105      0.00000
      2       6.2574      0.00000
      3       0.3252      0.00000
      4      -7.4800      0.00000
      5       1.0236      0.00000
      6       0.2858      0.00000
      7      -1.2772      0.00000
      8      -0.3205      0.00000
      9       0.1306      0.00000
     10       0.8072      0.00000
     11       4.4681      0.00000
     12      -2.9602      0.00000
     13      -3.4643      0.00000
     14       2.9996      0.00000
     15       0.8176      0.00000
     16       2.0171      0.00000
     17      -0.4136      0.00000
     18      -2.6168      0.00000
     19      -1.2284      0.00000
     20       3.9524      0.00000

 k-point 272 :       0.0000   -0.1667   -0.2083
  band No.  band energies     occupation 
      1       0.0012      0.00000
      2       4.8026      0.00000
      3      -7.7244      0.00000
      4       2.9708      0.00000
      5      -0.2644      0.00000
      6      -6.9616      0.00000
      7       7.0614      0.00000
      8       0.0669      0.00000
      9       0.0511      0.00000
     10      -0.0241      0.00000
     11       1.2648      0.00000
     12      -6.2740      0.00000
     13       6.6670      0.00000
     14      -1.6461      0.00000
     15      -9.1608      0.00000
     16       9.0620      0.00000
     17       0.6523      0.00000
     18      -0.1178      0.00000
     19      -0.7237      0.00000
     20       5.1406      0.00000

 k-point 273 :       0.0417    0.2917    0.2083
  band No.  band energies     occupation 
      1       0.0024      0.00000
      2       2.5818      0.00000
      3      -3.8925      0.00000
      4       1.3980      0.00000
      5      -0.7636      0.00000
      6       0.2011      0.00000
      7       0.2195      0.00000
      8       0.2725      0.00000
      9      -0.4836      0.00000
     10       0.3544      0.00000
     11       0.3622      0.00000
     12      -2.6124      0.00000
     13       4.0258      0.00000
     14      -1.4644      0.00000
     15      -4.5863      0.00000
     16       4.5310      0.00000
     17       1.6254      0.00000
     18      -0.7465      0.00000
     19      -1.6153      0.00000
     20       4.0923      0.00000

 k-point 274 :       0.2083    0.0417    0.2917
  band No.  band energies     occupation 
      1       0.0095      0.00000
      2       4.2182      0.00000
      3      -3.6263      0.00000
      4      -1.0761      0.00000
      5       0.5875      0.00000
      6      -0.9068      0.00000
      7      -0.4063      0.00000
      8      -0.0766      0.00000
      9      -0.0284      0.00000
     10       1.0023      0.00000
     11       2.1481      0.00000
     12      -0.3046      0.00000
     13      -2.6216      0.00000
     14       2.2149      0.00000
     15       0.9319      0.00000
     16       0.8338      0.00000
     17      -1.5228      0.00000
     18      -0.5170      0.00000
     19      -1.5789      0.00000
     20       2.1055      0.00000

 k-point 275 :       0.1667    0.2500   -0.0417
  band No.  band energies     occupation 
      1       0.0292      0.00000
      2       7.2819      0.00000
      3       1.5458      0.00000
      4     -10.7874      0.00000
      5       2.4872      0.00000
      6      -3.6276      0.00000
      7      -2.4263      0.00000
      8       2.1981      0.00000
      9      -0.6566      0.00000
     10       2.6573      0.00000
     11       7.2081      0.00000
     12      -3.9979      0.00000
     13      -3.4426      0.00000
     14       4.7892      0.00000
     15       2.1922      0.00000
     16       2.7054      0.00000
     17      -4.7796      0.00000
     18      -1.2255      0.00000
     19      -4.4365      0.00000
     20       3.9854      0.00000

 k-point 276 :       0.0833   -0.1667   -0.2083
  band No.  band energies     occupation 
      1      -0.0024      0.00000
      2      -2.5818      0.00000
      3       3.8925      0.00000
      4      -1.3980      0.00000
      5       0.7636      0.00000
      6      -0.2012      0.00000
      7      -0.2195      0.00000
      8      -0.2725      0.00000
      9       0.4836      0.00000
     10      -0.3545      0.00000
     11      -0.3622      0.00000
     12       2.6124      0.00000
     13      -4.0258      0.00000
     14       1.4644      0.00000
     15       4.5863      0.00000
     16      -4.5310      0.00000
     17      -1.6254      0.00000
     18       0.7465      0.00000
     19       1.6153      0.00000
     20      -4.0923      0.00000

 k-point 277 :      -0.2500   -0.0833   -0.2917
  band No.  band energies     occupation 
      1      -0.0095      0.00000
      2      -4.2182      0.00000
      3       3.6263      0.00000
      4       1.0761      0.00000
      5      -0.5875      0.00000
      6       0.9068      0.00000
      7       0.4063      0.00000
      8       0.0766      0.00000
      9       0.0284      0.00000
     10      -1.0023      0.00000
     11      -2.1481      0.00000
     12       0.3046      0.00000
     13       2.6216      0.00000
     14      -2.2149      0.00000
     15      -0.9319      0.00000
     16      -0.8338      0.00000
     17       1.5228      0.00000
     18       0.5170      0.00000
     19       1.5789      0.00000
     20      -2.1055      0.00000

 k-point 278 :       0.0417    0.3750    0.2083
  band No.  band energies     occupation 
      1      -0.0025      0.00000
      2       2.2070      0.00000
      3      -2.8580      0.00000
      4       0.7361      0.00000
      5      -3.5445      0.00000
      6       3.5077      0.00000
      7       0.2661      0.00000
      8       0.1339      0.00000
      9     -12.5324      0.00000
     10      11.7091      0.00000
     11      -0.3570      0.00000
     12      -0.0106      0.00000
     13      -1.6638      0.00000
     14       3.3296      0.00000
     15       6.9344      0.00000
     16      -7.1029      0.00000
     17       4.5644      0.00000
     18      -2.2372      0.00000
     19      -5.7704      0.00000
     20       6.2310      0.00000

 k-point 279 :       0.2083    0.0417    0.3750
  band No.  band energies     occupation 
      1       0.0069      0.00000
      2       3.8807      0.00000
      3      -5.8003      0.00000
      4       1.3455      0.00000
      5       1.2044      0.00000
      6      -4.2118      0.00000
      7       0.6406      0.00000
      8      -0.9871      0.00000
      9      -0.4492      0.00000
     10       3.4419      0.00000
     11       4.1191      0.00000
     12      -0.6060      0.00000
     13      -3.0077      0.00000
     14       2.3372      0.00000
     15       4.5935      0.00000
     16      -0.5855      0.00000
     17      -1.7228      0.00000
     18      -1.8523      0.00000
     19      -4.3375      0.00000
     20      -0.1411      0.00000

 k-point 280 :       0.1667    0.3333   -0.0417
  band No.  band energies     occupation 
      1       0.0185      0.00000
      2       4.4464      0.00000
      3       3.4269      0.00000
      4      -9.6279      0.00000
      5       2.7892      0.00000
      6     -10.8794      0.00000
      7       8.0489      0.00000
      8      -3.3580      0.00000
      9      -1.0693      0.00000
     10       3.6716      0.00000
     11       7.4989      0.00000
     12      -1.2235      0.00000
     13      -2.3159      0.00000
     14       2.5983      0.00000
     15       4.1836      0.00000
     16       1.9677      0.00000
     17      -3.8274      0.00000
     18      -1.7320      0.00000
     19      -7.5058      0.00000
     20      -0.5215      0.00000

 k-point 281 :       0.1667   -0.1667   -0.2083
  band No.  band energies     occupation 
      1       0.0025      0.00000
      2      -2.2070      0.00000
      3       2.8580      0.00000
      4      -0.7361      0.00000
      5       3.5445      0.00000
      6      -3.5077      0.00000
      7      -0.2661      0.00000
      8      -0.1338      0.00000
      9      12.5324      0.00000
     10     -11.7091      0.00000
     11       0.3570      0.00000
     12       0.0106      0.00000
     13       1.6638      0.00000
     14      -3.3296      0.00000
     15      -6.9344      0.00000
     16       7.1029      0.00000
     17      -4.5644      0.00000
     18       2.2372      0.00000
     19       5.7704      0.00000
     20      -6.2310      0.00000

 k-point 282 :      -0.3333   -0.1667   -0.3750
  band No.  band energies     occupation 
      1      -0.0069      0.00000
      2      -3.8807      0.00000
      3       5.8003      0.00000
      4      -1.3455      0.00000
      5      -1.2044      0.00000
      6       4.2118      0.00000
      7      -0.6406      0.00000
      8       0.9871      0.00000
      9       0.4492      0.00000
     10      -3.4419      0.00000
     11      -4.1191      0.00000
     12       0.6060      0.00000
     13       3.0077      0.00000
     14      -2.3372      0.00000
     15      -4.5935      0.00000
     16       0.5855      0.00000
     17       1.7228      0.00000
     18       1.8523      0.00000
     19       4.3375      0.00000
     20       0.1411      0.00000

 k-point 283 :       0.0417    0.4583    0.2083
  band No.  band energies     occupation 
      1      -0.1054      0.00000
      2       2.1528      0.00000
      3       1.7980      0.00000
      4      -4.0931      0.00000
      5      -6.1804      0.00000
      6       6.1923      0.00000
      7      -3.7926      0.00000
      8       4.8185      0.00000
      9      -6.2292      0.00000
     10       4.7708      0.00000
     11      -0.9545      0.00000
     12       0.1797      0.00000
     13      -0.7055      0.00000
     14       7.7528      0.00000
     15       5.6383      0.00000
     16       6.3994      0.00000
     17     -10.7210      0.00000
     18      -9.5541      0.00000
     19      -3.2286      0.00000
     20       1.9455      0.00000

 k-point 284 :       0.2083    0.0417    0.4583
  band No.  band energies     occupation 
      1      -0.1210      0.00000
      2       3.1852      0.00000
      3      -8.3012      0.00000
      4       4.9331      0.00000
      5       1.8120      0.00000
      6      -7.5600      0.00000
      7       6.0628      0.00000
      8      -6.3168      0.00000
      9       3.7151      0.00000
     10       0.6300      0.00000
     11       6.1479      0.00000
     12      -0.6864      0.00000
     13       2.5745      0.00000
     14      -0.0136      0.00000
     15      -0.5514      0.00000
     16      -1.5499      0.00000
     17       3.3295      0.00000
     18      -6.1524      0.00000
     19      -2.1618      0.00000
     20      -4.2850      0.00000

 k-point 285 :       0.1667    0.4167   -0.0417
  band No.  band energies     occupation 
      1      -0.1271      0.00000
      2       3.3381      0.00000
      3       1.5935      0.00000
      4      -5.9532      0.00000
      5       1.9334      0.00000
      6      -5.8545      0.00000
      7       2.3179      0.00000
      8      -4.0735      0.00000
      9       5.4806      0.00000
     10      -2.2982      0.00000
     11       5.8103      0.00000
     12       2.4582      0.00000
     13       0.8920      0.00000
     14       5.2722      0.00000
     15      -1.3337      0.00000
     16      -5.1243      0.00000
     17       5.7399      0.00000
     18     -10.2203      0.00000
     19       0.2717      0.00000
     20      -6.8899      0.00000

 k-point 286 :       0.2500   -0.1667   -0.2083
  band No.  band energies     occupation 
      1       0.1054      0.00000
      2      -2.1528      0.00000
      3      -1.7980      0.00000
      4       4.0931      0.00000
      5       6.1804      0.00000
      6      -6.1923      0.00000
      7       3.7926      0.00000
      8      -4.8185      0.00000
      9       6.2292      0.00000
     10      -4.7708      0.00000
     11       0.9545      0.00000
     12      -0.1797      0.00000
     13       0.7055      0.00000
     14      -7.7528      0.00000
     15      -5.6383      0.00000
     16      -6.3994      0.00000
     17      10.7210      0.00000
     18       9.5541      0.00000
     19       3.2286      0.00000
     20      -1.9455      0.00000

 k-point 287 :      -0.4167   -0.2500   -0.4583
  band No.  band energies     occupation 
      1       0.1210      0.00000
      2      -3.1852      0.00000
      3       8.3012      0.00000
      4      -4.9331      0.00000
      5      -1.8120      0.00000
      6       7.5600      0.00000
      7      -6.0628      0.00000
      8       6.3168      0.00000
      9      -3.7151      0.00000
     10      -0.6300      0.00000
     11      -6.1479      0.00000
     12       0.6864      0.00000
     13      -2.5745      0.00000
     14       0.0136      0.00000
     15       0.5514      0.00000
     16       1.5499      0.00000
     17      -3.3295      0.00000
     18       6.1524      0.00000
     19       2.1618      0.00000
     20       4.2850      0.00000

 k-point 288 :       0.0417   -0.4583    0.2083
  band No.  band energies     occupation 
      1      -0.8927      0.00000
      2       3.0299      0.00000
      3       3.8848      0.00000
      4      -6.8692      0.00000
      5      -7.0778      0.00000
      6       8.0281      0.00000
      7      -2.4027      0.00000
      8       1.5871      0.00000
      9      -0.9967      0.00000
     10      -0.0703      0.00000
     11      -3.2665      0.00000
     12       4.2967      0.00000
     13       0.8034      0.00000
     14       5.1222      0.00000
     15       7.7843      0.00000
     16       8.1344      0.00000
     17      -1.6466      0.00000
     18     -15.7443      0.00000
     19     -13.6421      0.00000
     20       8.8042      0.00000

 k-point 289 :       0.2083    0.0417   -0.4583
  band No.  band energies     occupation 
      1      -0.9638      0.00000
      2       3.5611      0.00000
      3      -6.2615      0.00000
      4       3.6188      0.00000
      5       2.3629      0.00000
      6      -8.9713      0.00000
      7       2.7544      0.00000
      8      -5.1032      0.00000
      9       6.3213      0.00000
     10      -1.1319      0.00000
     11       9.0629      0.00000
     12      -2.3436      0.00000
     13       2.6692      0.00000
     14       2.7203      0.00000
     15      -0.7283      0.00000
     16      -1.5709      0.00000
     17       2.1639      0.00000
     18      -3.4265      0.00000
     19       0.5394      0.00000
     20     -12.3394      0.00000

 k-point 290 :       0.1667   -0.5000   -0.0417
  band No.  band energies     occupation 
      1      -0.9869      0.00000
      2       3.5710      0.00000
      3      -1.8004      0.00000
      4      -1.3792      0.00000
      5       0.5026      0.00000
      6      -3.2342      0.00000
      7      -0.8643      0.00000
      8      -4.7140      0.00000
      9       8.1055      0.00000
     10      -4.0888      0.00000
     11       8.2467      0.00000
     12      -1.9629      0.00000
     13       4.5977      0.00000
     14       1.0314      0.00000
     15       3.0719      0.00000
     16      -5.5034      0.00000
     17       8.0462      0.00000
     18       7.2576      0.00000
     19     -13.9574      0.00000
     20     -12.9476      0.00000

 k-point 291 :      -0.6667   -0.1667   -0.2083
  band No.  band energies     occupation 
      1       0.8927      0.00000
      2      -3.0299      0.00000
      3      -3.8848      0.00000
      4       6.8692      0.00000
      5       7.0778      0.00000
      6      -8.0281      0.00000
      7       2.4027      0.00000
      8      -1.5871      0.00000
      9       0.9967      0.00000
     10       0.0703      0.00000
     11       3.2665      0.00000
     12      -4.2967      0.00000
     13      -0.8034      0.00000
     14      -5.1222      0.00000
     15      -7.7843      0.00000
     16      -8.1344      0.00000
     17       1.6466      0.00000
     18      15.7443      0.00000
     19      13.6421      0.00000
     20      -8.8042      0.00000

 k-point 292 :       0.5000    0.6667    0.4583
  band No.  band energies     occupation 
      1       0.9638      0.00000
      2      -3.5611      0.00000
      3       6.2615      0.00000
      4      -3.6188      0.00000
      5      -2.3629      0.00000
      6       8.9713      0.00000
      7      -2.7544      0.00000
      8       5.1032      0.00000
      9      -6.3213      0.00000
     10       1.1319      0.00000
     11      -9.0629      0.00000
     12       2.3436      0.00000
     13      -2.6692      0.00000
     14      -2.7203      0.00000
     15       0.7283      0.00000
     16       1.5709      0.00000
     17      -2.1639      0.00000
     18       3.4265      0.00000
     19      -0.5394      0.00000
     20      12.3394      0.00000

 k-point 293 :       0.0417   -0.3750    0.2083
  band No.  band energies     occupation 
      1      -0.9973      0.00000
      2       3.4879      0.00000
      3       3.7182      0.00000
      4      -7.8288      0.00000
      5      -7.0889      0.00000
      6       9.6203      0.00000
      7      -3.6135      0.00000
      8      -4.3644      0.00000
      9       7.6615      0.00000
     10      -4.9726      0.00000
     11      -0.8783      0.00000
     12       7.4065      0.00000
     13       0.5860      0.00000
     14       0.5518      0.00000
     15       8.9524      0.00000
     16      -1.6200      0.00000
     17      12.8436      0.00000
     18      -3.6989      0.00000
     19     -15.8876      0.00000
     20      -3.6821      0.00000

 k-point 294 :       0.2083    0.0417   -0.3750
  band No.  band energies     occupation 
      1      -0.8927      0.00000
      2       3.3601      0.00000
      3      -4.6746      0.00000
      4       2.3245      0.00000
      5       2.9373      0.00000
      6      -9.3223      0.00000
      7       3.3664      0.00000
      8      -8.9795      0.00000
      9       9.4958      0.00000
     10       6.1060      0.00000
     11      -2.2218      0.00000
     12      -0.0766      0.00000
     13       1.7729      0.00000
     14       4.9660      0.00000
     15       1.0667      0.00000
     16      -0.8950      0.00000
     17      -6.0075      0.00000
     18       5.9295      0.00000
     19     -10.5475      0.00000
     20      -3.8867      0.00000

 k-point 295 :       0.1667   -0.4167   -0.0417
  band No.  band energies     occupation 
      1      -0.8752      0.00000
      2       3.2129      0.00000
      3      -2.6907      0.00000
      4       0.1939      0.00000
      5      -0.9147      0.00000
      6      -1.9655      0.00000
      7      -0.5805      0.00000
      8      -5.7322      0.00000
      9       8.2878      0.00000
     10       3.5623      0.00000
     11      -1.3540      0.00000
     12      -2.3228      0.00000
     13       6.1088      0.00000
     14       2.4406      0.00000
     15       3.9874      0.00000
     16      -0.9705      0.00000
     17      -5.9642      0.00000
     18      -7.0029      0.00000
     19       4.5556      0.00000
     20      -7.5909      0.00000

 k-point 296 :      -0.5833   -0.1667   -0.2083
  band No.  band energies     occupation 
      1       0.9973      0.00000
      2      -3.4879      0.00000
      3      -3.7182      0.00000
      4       7.8288      0.00000
      5       7.0889      0.00000
      6      -9.6203      0.00000
      7       3.6135      0.00000
      8       4.3644      0.00000
      9      -7.6615      0.00000
     10       4.9726      0.00000
     11       0.8783      0.00000
     12      -7.4065      0.00000
     13      -0.5860      0.00000
     14      -0.5518      0.00000
     15      -8.9524      0.00000
     16       1.6200      0.00000
     17     -12.8436      0.00000
     18       3.6989      0.00000
     19      15.8876      0.00000
     20       3.6821      0.00000

 k-point 297 :       0.4167    0.5833    0.3750
  band No.  band energies     occupation 
      1       0.8927      0.00000
      2      -3.3601      0.00000
      3       4.6746      0.00000
      4      -2.3245      0.00000
      5      -2.9373      0.00000
      6       9.3223      0.00000
      7      -3.3664      0.00000
      8       8.9795      0.00000
      9      -9.4958      0.00000
     10      -6.1060      0.00000
     11       2.2218      0.00000
     12       0.0766      0.00000
     13      -1.7729      0.00000
     14      -4.9660      0.00000
     15      -1.0667      0.00000
     16       0.8950      0.00000
     17       6.0075      0.00000
     18      -5.9295      0.00000
     19      10.5475      0.00000
     20       3.8867      0.00000

 k-point 298 :       0.0417   -0.2917    0.2083
  band No.  band energies     occupation 
      1      -0.1320      0.00000
      2       3.4382      0.00000
      3       3.0724      0.00000
      4      -8.8914      0.00000
      5      -6.4333      0.00000
      6      10.5714      0.00000
      7      -6.9200      0.00000
      8      -2.1506      0.00000
      9       8.5803      0.00000
     10      -3.6725      0.00000
     11      -0.3602      0.00000
     12       7.6868      0.00000
     13      -0.5182      0.00000
     14       7.0437      0.00000
     15      -2.8187      0.00000
     16       0.5438      0.00000
     17      11.1162      0.00000
     18      -5.1393      0.00000
     19      -9.3846      0.00000
     20     -13.7108      0.00000

 k-point 299 :       0.2083    0.0417   -0.2917
  band No.  band energies     occupation 
      1      -0.1006      0.00000
      2       2.7159      0.00000
      3      -3.8749      0.00000
      4       1.4150      0.00000
      5       4.0598      0.00000
      6      -8.7001      0.00000
      7       3.2957      0.00000
      8      -5.6889      0.00000
      9       5.9515      0.00000
     10       3.9632      0.00000
     11      -2.9616      0.00000
     12       0.3912      0.00000
     13       1.1614      0.00000
     14       3.9897      0.00000
     15       2.7950      0.00000
     16      -2.3819      0.00000
     17      -2.1324      0.00000
     18      -4.1037      0.00000
     19       0.8490      0.00000
     20      -3.8166      0.00000

 k-point 300 :       0.1667   -0.3333   -0.0417
  band No.  band energies     occupation 
      1      -0.0972      0.00000
      2       2.4553      0.00000
      3      -2.8851      0.00000
      4       0.6121      0.00000
      5      -2.6675      0.00000
      6       0.2145      0.00000
      7      -0.1212      0.00000
      8      -1.2906      0.00000
      9       1.4977      0.00000
     10       4.8564      0.00000
     11      -2.6447      0.00000
     12      -1.3408      0.00000
     13       1.3517      0.00000
     14       4.8022      0.00000
     15       4.9854      0.00000
     16      -1.5387      0.00000
     17      -5.4748      0.00000
     18      -2.0525      0.00000
     19      -5.0550      0.00000
     20       0.4136      0.00000

 k-point 301 :      -0.5000   -0.1667   -0.2083
  band No.  band energies     occupation 
      1       0.1320      0.00000
      2      -3.4382      0.00000
      3      -3.0724      0.00000
      4       8.8914      0.00000
      5       6.4333      0.00000
      6     -10.5714      0.00000
      7       6.9200      0.00000
      8       2.1506      0.00000
      9      -8.5803      0.00000
     10       3.6725      0.00000
     11       0.3602      0.00000
     12      -7.6868      0.00000
     13       0.5182      0.00000
     14      -7.0437      0.00000
     15       2.8187      0.00000
     16      -0.5438      0.00000
     17     -11.1162      0.00000
     18       5.1393      0.00000
     19       9.3846      0.00000
     20      13.7108      0.00000

 k-point 302 :       0.3333    0.5000    0.2917
  band No.  band energies     occupation 
      1       0.1006      0.00000
      2      -2.7159      0.00000
      3       3.8749      0.00000
      4      -1.4150      0.00000
      5      -4.0598      0.00000
      6       8.7001      0.00000
      7      -3.2957      0.00000
      8       5.6889      0.00000
      9      -5.9515      0.00000
     10      -3.9632      0.00000
     11       2.9616      0.00000
     12      -0.3912      0.00000
     13      -1.1614      0.00000
     14      -3.9897      0.00000
     15      -2.7950      0.00000
     16       2.3819      0.00000
     17       2.1324      0.00000
     18       4.1037      0.00000
     19      -0.8490      0.00000
     20       3.8166      0.00000

 k-point 303 :       0.0417   -0.2083    0.2083
  band No.  band energies     occupation 
      1       0.0336      0.00000
      2       5.6296      0.00000
      3       1.2040      0.00000
      4     -10.3119      0.00000
      5       9.7766      0.00000
      6      -3.8716      0.00000
      7     -10.6177      0.00000
      8       1.8611      0.00000
      9      -2.4177      0.00000
     10       6.6374      0.00000
     11       1.7685      0.00000
     12       4.7631      0.00000
     13       3.5967      0.00000
     14      -1.9717      0.00000
     15       7.1614      0.00000
     16      -7.2191      0.00000
     17       6.9645      0.00000
     18      -6.4782      0.00000
     19      -0.5880      0.00000
     20      -8.6614      0.00000

 k-point 304 :       0.2083    0.0417   -0.2083
  band No.  band energies     occupation 
      1      -0.0013      0.00000
      2       2.5801      0.00000
      3      -3.0084      0.00000
      4       0.4864      0.00000
      5       3.9009      0.00000
      6      -5.4488      0.00000
      7       1.0664      0.00000
      8      -1.5697      0.00000
      9       2.4528      0.00000
     10       0.6912      0.00000
     11      -1.1472      0.00000
     12       0.6569      0.00000
     13      -0.5391      0.00000
     14       1.5605      0.00000
     15       0.1023      0.00000
     16       1.0124      0.00000
     17      -0.5979      0.00000
     18      -0.8182      0.00000
     19      -0.3428      0.00000
     20      -2.0159      0.00000

 k-point 305 :       0.1667   -0.2500   -0.0417
  band No.  band energies     occupation 
      1      -0.0019      0.00000
      2       2.2528      0.00000
      3      -2.5326      0.00000
      4       0.3773      0.00000
      5      -5.5015      0.00000
      6       4.4769      0.00000
      7       0.1418      0.00000
      8      -0.1656      0.00000
      9      -1.4050      0.00000
     10       3.2526      0.00000
     11      -1.0318      0.00000
     12      -0.2873      0.00000
     13       0.6492      0.00000
     14       0.4329      0.00000
     15       0.5283      0.00000
     16       2.3500      0.00000
     17      -1.6095      0.00000
     18      -0.4295      0.00000
     19      -1.5235      0.00000
     20      -1.3798      0.00000

 k-point 306 :      -0.4167   -0.1667   -0.2083
  band No.  band energies     occupation 
      1      -0.0336      0.00000
      2      -5.6296      0.00000
      3      -1.2040      0.00000
      4      10.3119      0.00000
      5      -9.7766      0.00000
      6       3.8716      0.00000
      7      10.6177      0.00000
      8      -1.8611      0.00000
      9       2.4177      0.00000
     10      -6.6374      0.00000
     11      -1.7685      0.00000
     12      -4.7631      0.00000
     13      -3.5967      0.00000
     14       1.9717      0.00000
     15      -7.1614      0.00000
     16       7.2191      0.00000
     17      -6.9645      0.00000
     18       6.4782      0.00000
     19       0.5880      0.00000
     20       8.6614      0.00000

 k-point 307 :       0.2500    0.4167    0.2083
  band No.  band energies     occupation 
      1       0.0013      0.00000
      2      -2.5801      0.00000
      3       3.0083      0.00000
      4      -0.4864      0.00000
      5      -3.9009      0.00000
      6       5.4487      0.00000
      7      -1.0664      0.00000
      8       1.5697      0.00000
      9      -2.4528      0.00000
     10      -0.6912      0.00000
     11       1.1472      0.00000
     12      -0.6569      0.00000
     13       0.5391      0.00000
     14      -1.5605      0.00000
     15      -0.1023      0.00000
     16      -1.0124      0.00000
     17       0.5979      0.00000
     18       0.8182      0.00000
     19       0.3428      0.00000
     20       2.0159      0.00000

 k-point 308 :       0.0417   -0.1250    0.2083
  band No.  band energies     occupation 
      1       0.0555      0.00000
      2       6.4525      0.00000
      3       1.3482      0.00000
      4     -11.8829      0.00000
      5      10.0449      0.00000
      6      -1.9776      0.00000
      7     -10.0130      0.00000
      8      -0.0884      0.00000
      9      -0.7339      0.00000
     10       4.8018      0.00000
     11       3.9136      0.00000
     12       0.5787      0.00000
     13       0.7601      0.00000
     14       3.4754      0.00000
     15       5.9492      0.00000
     16       5.8763      0.00000
     17      -9.2796      0.00000
     18      -5.3321      0.00000
     19      -3.7270      0.00000
     20       2.3758      0.00000

 k-point 309 :       0.2083    0.0417   -0.1250
  band No.  band energies     occupation 
      1      -0.0070      0.00000
      2      -2.9873      0.00000
      3       3.4178      0.00000
      4      -0.4222      0.00000
      5       0.2758      0.00000
      6       1.0873      0.00000
      7      -0.6952      0.00000
      8       0.9794      0.00000
      9      -1.4433      0.00000
     10      -1.2738      0.00000
     11       0.8859      0.00000
     12      -0.4423      0.00000
     13       0.4645      0.00000
     14      -0.6106      0.00000
     15      -0.3488      0.00000
     16      -1.7408      0.00000
     17       0.7147      0.00000
     18       0.7368      0.00000
     19       1.5593      0.00000
     20       0.5246      0.00000

 k-point 310 :       0.1667   -0.1667   -0.0417
  band No.  band energies     occupation 
      1      -0.0053      0.00000
      2      -2.6683      0.00000
      3       3.1380      0.00000
      4      -0.5751      0.00000
      5       1.8581      0.00000
      6      -0.8951      0.00000
      7      -0.1831      0.00000
      8       0.1727      0.00000
      9      -0.2789      0.00000
     10      -1.3087      0.00000
     11       0.7370      0.00000
     12       0.2757      0.00000
     13      -0.8398      0.00000
     14       0.7112      0.00000
     15       0.5378      0.00000
     16      -1.6155      0.00000
     17      -1.8146      0.00000
     18       0.8400      0.00000
     19       2.9143      0.00000
     20      -0.1370      0.00000

 k-point 311 :      -0.3333   -0.1667   -0.2083
  band No.  band energies     occupation 
      1      -0.0555      0.00000
      2      -6.4525      0.00000
      3      -1.3482      0.00000
      4      11.8829      0.00000
      5     -10.0449      0.00000
      6       1.9776      0.00000
      7      10.0130      0.00000
      8       0.0884      0.00000
      9       0.7339      0.00000
     10      -4.8018      0.00000
     11      -3.9136      0.00000
     12      -0.5787      0.00000
     13      -0.7601      0.00000
     14      -3.4754      0.00000
     15      -5.9492      0.00000
     16      -5.8763      0.00000
     17       9.2796      0.00000
     18       5.3321      0.00000
     19       3.7270      0.00000
     20      -2.3758      0.00000

 k-point 312 :       0.1667    0.3333    0.1250
  band No.  band energies     occupation 
      1       0.0070      0.00000
      2       2.9873      0.00000
      3      -3.4178      0.00000
      4       0.4222      0.00000
      5      -0.2758      0.00000
      6      -1.0873      0.00000
      7       0.6952      0.00000
      8      -0.9794      0.00000
      9       1.4433      0.00000
     10       1.2738      0.00000
     11      -0.8859      0.00000
     12       0.4423      0.00000
     13      -0.4645      0.00000
     14       0.6106      0.00000
     15       0.3488      0.00000
     16       1.7408      0.00000
     17      -0.7147      0.00000
     18      -0.7368      0.00000
     19      -1.5593      0.00000
     20      -0.5246      0.00000

 k-point 313 :       0.0417   -0.0417    0.2083
  band No.  band energies     occupation 
      1       0.0403      0.00000
      2       4.7796      0.00000
      3       4.3424      0.00000
      4     -12.2187      0.00000
      5       7.6616      0.00000
      6      -7.7641      0.00000
      7      -0.0837      0.00000
      8      -2.0988      0.00000
      9       3.0403      0.00000
     10       1.4858      0.00000
     11       6.0294      0.00000
     12      -4.1359      0.00000
     13      -1.8795      0.00000
     14       5.8643      0.00000
     15      -2.5021      0.00000
     16       5.9702      0.00000
     17       3.8889      0.00000
     18      -8.9383      0.00000
     19      -0.5540      0.00000
     20       0.2813      0.00000

 k-point 314 :       0.2083    0.0417   -0.0417
  band No.  band energies     occupation 
      1      -0.0239      0.00000
      2      -4.0622      0.00000
      3       4.0792      0.00000
      4       0.8437      0.00000
      5      -0.4254      0.00000
      6       1.2502      0.00000
      7       0.2499      0.00000
      8       1.8759      0.00000
      9      -1.7143      0.00000
     10      -3.5931      0.00000
     11      -1.1728      0.00000
     12       2.2170      0.00000
     13       0.1588      0.00000
     14      -2.0431      0.00000
     15      -2.7124      0.00000
     16       5.3669      0.00000
     17      -7.1925      0.00000
     18       3.4297      0.00000
     19       2.7186      0.00000
     20       0.2736      0.00000

 k-point 315 :       0.1667   -0.0833   -0.0417
  band No.  band energies     occupation 
      1      -0.0171      0.00000
      2      -3.6595      0.00000
      3       6.7704      0.00000
      4      -3.1867      0.00000
      5       4.1052      0.00000
      6      -8.5608      0.00000
      7       6.0754      0.00000
      8       0.8032      0.00000
      9      -4.9520      0.00000
     10       1.4522      0.00000
     11      -0.4267      0.00000
     12       1.9311      0.00000
     13      -3.5489      0.00000
     14       3.0652      0.00000
     15      -4.9092      0.00000
     16       8.8906      0.00000
     17      -3.6707      0.00000
     18      -4.2057      0.00000
     19       6.3802      0.00000
     20      -0.6943      0.00000

 k-point 316 :      -0.2500   -0.1667   -0.2083
  band No.  band energies     occupation 
      1      -0.0403      0.00000
      2      -4.7796      0.00000
      3      -4.3424      0.00000
      4      12.2187      0.00000
      5      -7.6616      0.00000
      6       7.7641      0.00000
      7       0.0837      0.00000
      8       2.0988      0.00000
      9      -3.0403      0.00000
     10      -1.4858      0.00000
     11      -6.0294      0.00000
     12       4.1359      0.00000
     13       1.8795      0.00000
     14      -5.8643      0.00000
     15       2.5021      0.00000
     16      -5.9702      0.00000
     17      -3.8889      0.00000
     18       8.9383      0.00000
     19       0.5540      0.00000
     20      -0.2813      0.00000

 k-point 317 :       0.0833    0.2500    0.0417
  band No.  band energies     occupation 
      1       0.0239      0.00000
      2       4.0622      0.00000
      3      -4.0792      0.00000
      4      -0.8437      0.00000
      5       0.4254      0.00000
      6      -1.2502      0.00000
      7      -0.2500      0.00000
      8      -1.8759      0.00000
      9       1.7143      0.00000
     10       3.5931      0.00000
     11       1.1728      0.00000
     12      -2.2170      0.00000
     13      -0.1588      0.00000
     14       2.0431      0.00000
     15       2.7124      0.00000
     16      -5.3669      0.00000
     17       7.1925      0.00000
     18      -3.4297      0.00000
     19      -2.7186      0.00000
     20      -0.2736      0.00000

 k-point 318 :       0.0417    0.2917    0.2917
  band No.  band energies     occupation 
      1      -0.0004      0.00000
      2      -1.3057      0.00000
      3       6.2038      0.00000
      4      -4.9138      0.00000
      5       0.2773      0.00000
      6      -0.2127      0.00000
      7      -6.8503      0.00000
      8       6.7292      0.00000
      9       0.3628      0.00000
     10      -0.2465      0.00000
     11      -0.1784      0.00000
     12       3.2752      0.00000
     13      -4.0741      0.00000
     14       0.5927      0.00000
     15       4.3853      0.00000
     16      -4.1874      0.00000
     17      -0.4101      0.00000
     18       0.4909      0.00000
     19       0.2019      0.00000
     20     -15.0874      0.00000

 k-point 319 :       0.2500    0.2500   -0.0417
  band No.  band energies     occupation 
      1       0.0079      0.00000
      2       5.9727      0.00000
      3       0.2298      0.00000
      4      -6.7349      0.00000
      5       0.7072      0.00000
      6      -0.6575      0.00000
      7      -1.3917      0.00000
      8       0.7288      0.00000
      9      -0.4562      0.00000
     10       1.0307      0.00000
     11       5.3519      0.00000
     12      -3.4104      0.00000
     13      -4.1376      0.00000
     14       4.2503      0.00000
     15       1.0885      0.00000
     16      -0.1775      0.00000
     17      -1.2969      0.00000
     18      -1.9094      0.00000
     19      -0.2463      0.00000
     20       1.8179      0.00000

 k-point 320 :       0.0000   -0.2500   -0.2917
  band No.  band energies     occupation 
      1       0.0004      0.00000
      2       1.3057      0.00000
      3      -6.2038      0.00000
      4       4.9138      0.00000
      5      -0.2773      0.00000
      6       0.2127      0.00000
      7       6.8503      0.00000
      8      -6.7292      0.00000
      9      -0.3628      0.00000
     10       0.2465      0.00000
     11       0.1784      0.00000
     12      -3.2752      0.00000
     13       4.0741      0.00000
     14      -0.5927      0.00000
     15      -4.3853      0.00000
     16       4.1874      0.00000
     17       0.4101      0.00000
     18      -0.4909      0.00000
     19      -0.2019      0.00000
     20      15.0874      0.00000

 k-point 321 :       0.0417    0.3750    0.2917
  band No.  band energies     occupation 
      1      -0.0020      0.00000
      2       0.5837      0.00000
      3       1.0593      0.00000
      4      -1.6602      0.00000
      5      -0.9045      0.00000
      6       0.8112      0.00000
      7       0.4515      0.00000
      8       0.0103      0.00000
      9      -2.8853      0.00000
     10       2.5231      0.00000
     11      -0.5290      0.00000
     12       0.0145      0.00000
     13      -1.0598      0.00000
     14       1.4630      0.00000
     15       5.1222      0.00000
     16      -4.7061      0.00000
     17       1.0411      0.00000
     18      -1.1649      0.00000
     19      -0.7361      0.00000
     20       6.1536      0.00000

 k-point 322 :       0.2917    0.0417    0.3750
  band No.  band energies     occupation 
      1      -0.0002      0.00000
      2       3.3436      0.00000
      3      -5.2948      0.00000
      4       1.6741      0.00000
      5       0.5171      0.00000
      6      -0.5810      0.00000
      7      -0.6554      0.00000
      8      -0.1072      0.00000
      9      -0.9572      0.00000
     10       1.4604      0.00000
     11       3.2502      0.00000
     12      -0.0406      0.00000
     13      -3.1297      0.00000
     14       1.8031      0.00000
     15       0.3360      0.00000
     16       0.3668      0.00000
     17      -0.7163      0.00000
     18      -1.7769      0.00000
     19      -0.2151      0.00000
     20       2.5928      0.00000

 k-point 323 :       0.2500    0.3333   -0.0417
  band No.  band energies     occupation 
      1       0.0030      0.00000
      2       6.5617      0.00000
      3      -0.4847      0.00000
      4      -7.1461      0.00000
      5       1.8481      0.00000
      6      -1.9710      0.00000
      7      -0.0253      0.00000
      8      -1.8621      0.00000
      9      -2.4255      0.00000
     10       3.6025      0.00000
     11       9.5792      0.00000
     12      -3.2486      0.00000
     13      -5.2471      0.00000
     14       5.2136      0.00000
     15      -1.4039      0.00000
     16       3.1993      0.00000
     17      -2.6172      0.00000
     18      -5.8984      0.00000
     19       0.0847      0.00000
     20      10.4584      0.00000

 k-point 324 :       0.0833   -0.2500   -0.2917
  band No.  band energies     occupation 
      1       0.0020      0.00000
      2      -0.5837      0.00000
      3      -1.0593      0.00000
      4       1.6602      0.00000
      5       0.9045      0.00000
      6      -0.8112      0.00000
      7      -0.4515      0.00000
      8      -0.0103      0.00000
      9       2.8853      0.00000
     10      -2.5231      0.00000
     11       0.5290      0.00000
     12      -0.0145      0.00000
     13       1.0598      0.00000
     14      -1.4630      0.00000
     15      -5.1222      0.00000
     16       4.7061      0.00000
     17      -1.0411      0.00000
     18       1.1649      0.00000
     19       0.7361      0.00000
     20      -6.1536      0.00000

 k-point 325 :      -0.3333   -0.0833   -0.3750
  band No.  band energies     occupation 
      1       0.0002      0.00000
      2      -3.3436      0.00000
      3       5.2948      0.00000
      4      -1.6741      0.00000
      5      -0.5171      0.00000
      6       0.5810      0.00000
      7       0.6554      0.00000
      8       0.1072      0.00000
      9       0.9572      0.00000
     10      -1.4604      0.00000
     11      -3.2502      0.00000
     12       0.0406      0.00000
     13       3.1297      0.00000
     14      -1.8031      0.00000
     15      -0.3360      0.00000
     16      -0.3668      0.00000
     17       0.7163      0.00000
     18       1.7769      0.00000
     19       0.2151      0.00000
     20      -2.5928      0.00000

 k-point 326 :       0.0417    0.4583    0.2917
  band No.  band energies     occupation 
      1      -0.0539      0.00000
      2       1.0884      0.00000
      3       4.0432      0.00000
      4      -5.3389      0.00000
      5      -3.9773      0.00000
      6       3.7588      0.00000
      7       2.9143      0.00000
      8      -0.5823      0.00000
      9     -12.9950      0.00000
     10      11.6409      0.00000
     11      -3.4146      0.00000
     12       0.5540      0.00000
     13      -1.1108      0.00000
     14       6.8580      0.00000
     15       5.3226      0.00000
     16      -0.6886      0.00000
     17      -3.8472      0.00000
     18      -4.1732      0.00000
     19      -1.3261      0.00000
     20       0.2601      0.00000

 k-point 327 :       0.2917    0.0417    0.4583
  band No.  band energies     occupation 
      1      -0.0775      0.00000
      2       4.2182      0.00000
      3      -7.3567      0.00000
      4       2.9241      0.00000
      5       1.1361      0.00000
      6      -1.7974      0.00000
      7      -2.4608      0.00000
      8       0.4842      0.00000
      9      -1.0921      0.00000
     10       2.0603      0.00000
     11       7.0346      0.00000
     12      -1.7662      0.00000
     13       2.3130      0.00000
     14      -1.1273      0.00000
     15      -4.4831      0.00000
     16       0.4373      0.00000
     17       3.0178      0.00000
     18      -4.1512      0.00000
     19       0.5505      0.00000
     20       5.6978      0.00000

 k-point 328 :       0.2500    0.4167   -0.0417
  band No.  band energies     occupation 
      1      -0.1004      0.00000
      2       4.8282      0.00000
      3      -3.0023      0.00000
      4      -2.6058      0.00000
      5       1.9205      0.00000
      6      -2.8820      0.00000
      7      -0.2859      0.00000
      8      -2.3717      0.00000
      9       2.0437      0.00000
     10      -0.4549      0.00000
     11       9.2849      0.00000
     12      -1.6975      0.00000
     13       0.2323      0.00000
     14       1.8627      0.00000
     15      -3.5270      0.00000
     16      -1.2902      0.00000
     17       4.6521      0.00000
     18      -9.0433      0.00000
     19       4.0371      0.00000
     20       8.6776      0.00000

 k-point 329 :       0.1667   -0.2500   -0.2917
  band No.  band energies     occupation 
      1       0.0539      0.00000
      2      -1.0884      0.00000
      3      -4.0432      0.00000
      4       5.3389      0.00000
      5       3.9773      0.00000
      6      -3.7588      0.00000
      7      -2.9143      0.00000
      8       0.5823      0.00000
      9      12.9950      0.00000
     10     -11.6409      0.00000
     11       3.4146      0.00000
     12      -0.5540      0.00000
     13       1.1108      0.00000
     14      -6.8580      0.00000
     15      -5.3226      0.00000
     16       0.6886      0.00000
     17       3.8472      0.00000
     18       4.1732      0.00000
     19       1.3261      0.00000
     20      -0.2601      0.00000

 k-point 330 :      -0.4167   -0.1667   -0.4583
  band No.  band energies     occupation 
      1       0.0775      0.00000
      2      -4.2182      0.00000
      3       7.3567      0.00000
      4      -2.9241      0.00000
      5      -1.1361      0.00000
      6       1.7974      0.00000
      7       2.4608      0.00000
      8      -0.4842      0.00000
      9       1.0921      0.00000
     10      -2.0603      0.00000
     11      -7.0346      0.00000
     12       1.7662      0.00000
     13      -2.3130      0.00000
     14       1.1273      0.00000
     15       4.4831      0.00000
     16      -0.4373      0.00000
     17      -3.0178      0.00000
     18       4.1512      0.00000
     19      -0.5505      0.00000
     20      -5.6978      0.00000

 k-point 331 :       0.0417   -0.4583    0.2917
  band No.  band energies     occupation 
      1      -0.4941      0.00000
      2       2.0961      0.00000
      3       3.7120      0.00000
      4      -6.0525      0.00000
      5      -5.4668      0.00000
      6       5.2240      0.00000
      7       5.3623      0.00000
      8      -0.7059      0.00000
      9      -8.1168      0.00000
     10       5.4347      0.00000
     11      -5.3391      0.00000
     12       1.9536      0.00000
     13       1.2433      0.00000
     14       5.5870      0.00000
     15       5.0248      0.00000
     16       6.1517      0.00000
     17      -5.0661      0.00000
     18       1.1928      0.00000
     19     -14.9856      0.00000
     20       7.6878      0.00000

 k-point 332 :       0.2917    0.0417   -0.4583
  band No.  band energies     occupation 
      1      -0.5898      0.00000
      2       4.0150      0.00000
      3      -5.4042      0.00000
      4       1.8595      0.00000
      5       1.1456      0.00000
      6      -3.3764      0.00000
      7      -3.2312      0.00000
      8       1.7623      0.00000
      9       0.4428      0.00000
     10       0.4362      0.00000
     11       6.7374      0.00000
     12      -1.1780      0.00000
     13       3.7547      0.00000
     14      -2.7342      0.00000
     15       0.4771      0.00000
     16      -2.6484      0.00000
     17      -6.0951      0.00000
     18       0.6835      0.00000
     19       7.9147      0.00000
     20      -1.9657      0.00000

 k-point 333 :       0.2500   -0.5000   -0.0417
  band No.  band energies     occupation 
      1      -0.6503      0.00000
      2       4.1147      0.00000
      3      -3.3127      0.00000
      4      -0.6572      0.00000
      5       0.9186      0.00000
      6      -3.1448      0.00000
      7      -0.1944      0.00000
      8      -2.7538      0.00000
      9       4.8223      0.00000
     10      -2.7205      0.00000
     11       7.0633      0.00000
     12      -2.4469      0.00000
     13       5.2707      0.00000
     14       0.1077      0.00000
     15       1.2894      0.00000
     16      -5.4607      0.00000
     17      -9.4617      0.00000
     18       5.6577      0.00000
     19       6.6519      0.00000
     20      -3.6372      0.00000

 k-point 334 :      -0.7500   -0.2500   -0.2917
  band No.  band energies     occupation 
      1       0.4941      0.00000
      2      -2.0961      0.00000
      3      -3.7120      0.00000
      4       6.0525      0.00000
      5       5.4668      0.00000
      6      -5.2240      0.00000
      7      -5.3623      0.00000
      8       0.7059      0.00000
      9       8.1168      0.00000
     10      -5.4347      0.00000
     11       5.3391      0.00000
     12      -1.9536      0.00000
     13      -1.2433      0.00000
     14      -5.5870      0.00000
     15      -5.0248      0.00000
     16      -6.1517      0.00000
     17       5.0661      0.00000
     18      -1.1928      0.00000
     19      14.9856      0.00000
     20      -7.6878      0.00000

 k-point 335 :       0.5000    0.7500    0.4583
  band No.  band energies     occupation 
      1       0.5898      0.00000
      2      -4.0150      0.00000
      3       5.4042      0.00000
      4      -1.8596      0.00000
      5      -1.1456      0.00000
      6       3.3764      0.00000
      7       3.2312      0.00000
      8      -1.7623      0.00000
      9      -0.4428      0.00000
     10      -0.4362      0.00000
     11      -6.7374      0.00000
     12       1.1780      0.00000
     13      -3.7547      0.00000
     14       2.7342      0.00000
     15      -0.4771      0.00000
     16       2.6484      0.00000
     17       6.0951      0.00000
     18      -0.6835      0.00000
     19      -7.9147      0.00000
     20       1.9657      0.00000

 k-point 336 :       0.0417   -0.3750    0.2917
  band No.  band energies     occupation 
      1      -1.8908      0.00000
      2       4.2603      0.00000
      3       2.9224      0.00000
      4      -6.6463      0.00000
      5      -5.7821      0.00000
      6      10.2363      0.00000
      7      -2.5978      0.00000
      8       2.4168      0.00000
      9      -3.0677      0.00000
     10      -4.5499      0.00000
     11       0.9146      0.00000
     12       2.8082      0.00000
     13       0.0987      0.00000
     14       4.2075      0.00000
     15       6.8768      0.00000
     16       2.6663      0.00000
     17       1.0953      0.00000
     18       0.8708      0.00000
     19      -1.4104      0.00000
     20      -8.8415      0.00000

 k-point 337 :       0.2917    0.0417   -0.3750
  band No.  band energies     occupation 
      1      -1.5055      0.00000
      2       4.4036      0.00000
      3      -4.0002      0.00000
      4       1.1179      0.00000
      5       0.9372      0.00000
      6      -6.5201      0.00000
      7       3.4949      0.00000
      8      -2.7906      0.00000
      9       2.2216      0.00000
     10       3.4488      0.00000
     11       0.5476      0.00000
     12      -0.1282      0.00000
     13       2.6372      0.00000
     14      -0.9857      0.00000
     15       5.0660      0.00000
     16      -2.9739      0.00000
     17      -4.4983      0.00000
     18      -6.5922      0.00000
     19       3.1381      0.00000
     20       2.9844      0.00000

 k-point 338 :       0.2500   -0.4167   -0.0417
  band No.  band energies     occupation 
      1      -1.5071      0.00000
      2       4.2376      0.00000
      3      -2.9114      0.00000
      4      -0.0069      0.00000
      5       0.1318      0.00000
      6      -2.2548      0.00000
      7       3.2152      0.00000
      8      -8.0880      0.00000
      9       6.5651      0.00000
     10      -0.3182      0.00000
     11       2.0292      0.00000
     12      -2.3054      0.00000
     13       5.9371      0.00000
     14       1.2730      0.00000
     15       4.0201      0.00000
     16      -4.1253      0.00000
     17      -9.7486      0.00000
     18      -3.2991      0.00000
     19       6.5099      0.00000
     20       1.1984      0.00000

 k-point 339 :      -0.6667   -0.2500   -0.2917
  band No.  band energies     occupation 
      1       1.8908      0.00000
      2      -4.2603      0.00000
      3      -2.9224      0.00000
      4       6.6463      0.00000
      5       5.7821      0.00000
      6     -10.2363      0.00000
      7       2.5978      0.00000
      8      -2.4168      0.00000
      9       3.0677      0.00000
     10       4.5499      0.00000
     11      -0.9146      0.00000
     12      -2.8082      0.00000
     13      -0.0987      0.00000
     14      -4.2075      0.00000
     15      -6.8768      0.00000
     16      -2.6663      0.00000
     17      -1.0953      0.00000
     18      -0.8708      0.00000
     19       1.4104      0.00000
     20       8.8415      0.00000

 k-point 340 :       0.4167    0.6667    0.3750
  band No.  band energies     occupation 
      1       1.5055      0.00000
      2      -4.4036      0.00000
      3       4.0002      0.00000
      4      -1.1179      0.00000
      5      -0.9372      0.00000
      6       6.5201      0.00000
      7      -3.4949      0.00000
      8       2.7906      0.00000
      9      -2.2216      0.00000
     10      -3.4488      0.00000
     11      -0.5476      0.00000
     12       0.1282      0.00000
     13      -2.6372      0.00000
     14       0.9857      0.00000
     15      -5.0660      0.00000
     16       2.9739      0.00000
     17       4.4983      0.00000
     18       6.5922      0.00000
     19      -3.1381      0.00000
     20      -2.9844      0.00000

 k-point 341 :       0.0417   -0.2917    0.2917
  band No.  band energies     occupation 
      1      -0.4778      0.00000
      2       4.5619      0.00000
      3       1.4163      0.00000
      4      -7.5431      0.00000
      5      -5.9101      0.00000
      6      11.0777      0.00000
      7      -7.2717      0.00000
      8      -3.4321      0.00000
      9       9.7836      0.00000
     10      -5.8312      0.00000
     11       0.6234      0.00000
     12       3.0624      0.00000
     13       6.6249      0.00000
     14      -2.3665      0.00000
     15       4.9111      0.00000
     16       1.5513      0.00000
     17       5.8133      0.00000
     18      -5.8233      0.00000
     19      -1.0047      0.00000
     20      -4.4284      0.00000

 k-point 342 :       0.2917    0.0417   -0.2917
  band No.  band energies     occupation 
      1      -0.1245      0.00000
      2       2.4297      0.00000
      3      -2.6809      0.00000
      4       0.4129      0.00000
      5       0.5014      0.00000
      6      -2.4365      0.00000
      7       6.9237      0.00000
      8      -8.7619      0.00000
      9       2.8197      0.00000
     10       1.8029      0.00000
     11      -0.6747      0.00000
     12      -0.0018      0.00000
     13      -0.1352      0.00000
     14       1.5687      0.00000
     15       5.4849      0.00000
     16      -5.1722      0.00000
     17      -2.4767      0.00000
     18       0.8787      0.00000
     19      -1.7029      0.00000
     20       0.3800      0.00000

 k-point 343 :       0.2500   -0.3333   -0.0417
  band No.  band energies     occupation 
      1      -0.1207      0.00000
      2       2.1475      0.00000
      3      -2.1450      0.00000
      4       0.1016      0.00000
      5      -0.1561      0.00000
      6      -0.6694      0.00000
      7       1.0361      0.00000
      8      -2.8601      0.00000
      9       2.2605      0.00000
     10       1.1649      0.00000
     11      -0.6720      0.00000
     12      -1.3499      0.00000
     13       1.3832      0.00000
     14       3.1025      0.00000
     15       4.1250      0.00000
     16      -4.8772      0.00000
     17      -3.0780      0.00000
     18      -0.1903      0.00000
     19       0.0127      0.00000
     20       1.3339      0.00000

 k-point 344 :      -0.5833   -0.2500   -0.2917
  band No.  band energies     occupation 
      1       0.4778      0.00000
      2      -4.5619      0.00000
      3      -1.4163      0.00000
      4       7.5431      0.00000
      5       5.9101      0.00000
      6     -11.0777      0.00000
      7       7.2717      0.00000
      8       3.4321      0.00000
      9      -9.7836      0.00000
     10       5.8312      0.00000
     11      -0.6234      0.00000
     12      -3.0624      0.00000
     13      -6.6249      0.00000
     14       2.3665      0.00000
     15      -4.9111      0.00000
     16      -1.5513      0.00000
     17      -5.8133      0.00000
     18       5.8233      0.00000
     19       1.0047      0.00000
     20       4.4284      0.00000

 k-point 345 :       0.3333    0.5833    0.2917
  band No.  band energies     occupation 
      1       0.1245      0.00000
      2      -2.4297      0.00000
      3       2.6809      0.00000
      4      -0.4129      0.00000
      5      -0.5014      0.00000
      6       2.4365      0.00000
      7      -6.9237      0.00000
      8       8.7619      0.00000
      9      -2.8197      0.00000
     10      -1.8029      0.00000
     11       0.6747      0.00000
     12       0.0018      0.00000
     13       0.1352      0.00000
     14      -1.5687      0.00000
     15      -5.4849      0.00000
     16       5.1722      0.00000
     17       2.4767      0.00000
     18      -0.8787      0.00000
     19       1.7029      0.00000
     20      -0.3800      0.00000

 k-point 346 :       0.0417   -0.2083    0.2917
  band No.  band energies     occupation 
      1      -0.0881      0.00000
      2       4.9698      0.00000
      3       1.2094      0.00000
      4      -8.8135      0.00000
      5      -5.8934      0.00000
      6      10.9055      0.00000
      7     -10.5731      0.00000
      8       1.6700      0.00000
      9       8.5877      0.00000
     10      -4.1283      0.00000
     11      -0.0034      0.00000
     12       5.5525      0.00000
     13       5.2710      0.00000
     14      -0.6599      0.00000
     15      -1.7018      0.00000
     16       2.0716      0.00000
     17      12.1919      0.00000
     18      -5.4838      0.00000
     19      -9.4274      0.00000
     20     -14.8885      0.00000

 k-point 347 :       0.2917    0.0417   -0.2083
  band No.  band energies     occupation 
      1       0.0293      0.00000
      2      -2.3922      0.00000
      3       2.7690      0.00000
      4      -0.4695      0.00000
      5      -1.2204      0.00000
      6       2.9816      0.00000
      7      -2.4533      0.00000
      8       3.2503      0.00000
      9      -2.1463      0.00000
     10      -1.3740      0.00000
     11       1.0134      0.00000
     12      -0.1088      0.00000
     13      -0.0482      0.00000
     14      -4.1722      0.00000
     15       0.3031      0.00000
     16       1.7845      0.00000
     17       1.0873      0.00000
     18       1.1002      0.00000
     19       0.2070      0.00000
     20       1.0619      0.00000

 k-point 348 :       0.2500   -0.2500   -0.0417
  band No.  band energies     occupation 
      1       0.0281      0.00000
      2      -2.0790      0.00000
      3       2.2320      0.00000
      4      -0.2157      0.00000
      5       0.7821      0.00000
      6       0.1501      0.00000
      7      -0.0213      0.00000
      8       0.3751      0.00000
      9      -0.0661      0.00000
     10      -2.0842      0.00000
     11       0.9526      0.00000
     12       1.2044      0.00000
     13      -1.3618      0.00000
     14      -3.2409      0.00000
     15      -1.9718      0.00000
     16       2.2672      0.00000
     17       2.2813      0.00000
     18       0.7480      0.00000
     19       0.8960      0.00000
     20       0.5501      0.00000

 k-point 349 :      -0.5000   -0.2500   -0.2917
  band No.  band energies     occupation 
      1       0.0881      0.00000
      2      -4.9698      0.00000
      3      -1.2094      0.00000
      4       8.8135      0.00000
      5       5.8934      0.00000
      6     -10.9055      0.00000
      7      10.5731      0.00000
      8      -1.6700      0.00000
      9      -8.5877      0.00000
     10       4.1283      0.00000
     11       0.0034      0.00000
     12      -5.5525      0.00000
     13      -5.2710      0.00000
     14       0.6599      0.00000
     15       1.7018      0.00000
     16      -2.0716      0.00000
     17     -12.1919      0.00000
     18       5.4838      0.00000
     19       9.4274      0.00000
     20      14.8885      0.00000

 k-point 350 :       0.2500    0.5000    0.2083
  band No.  band energies     occupation 
      1      -0.0293      0.00000
      2       2.3922      0.00000
      3      -2.7690      0.00000
      4       0.4695      0.00000
      5       1.2204      0.00000
      6      -2.9816      0.00000
      7       2.4533      0.00000
      8      -3.2503      0.00000
      9       2.1463      0.00000
     10       1.3740      0.00000
     11      -1.0134      0.00000
     12       0.1088      0.00000
     13       0.0482      0.00000
     14       4.1722      0.00000
     15      -0.3031      0.00000
     16      -1.7845      0.00000
     17      -1.0873      0.00000
     18      -1.1002      0.00000
     19      -0.2070      0.00000
     20      -1.0619      0.00000

 k-point 351 :       0.0417   -0.1250    0.2917
  band No.  band energies     occupation 
      1       0.0189      0.00000
      2       3.7197      0.00000
      3       3.4536      0.00000
      4     -10.2796      0.00000
      5       7.2987      0.00000
      6      -2.2381      0.00000
      7      -8.4347      0.00000
      8      -0.6386      0.00000
      9       1.6405      0.00000
     10       2.8405      0.00000
     11       2.1854      0.00000
     12       5.0388      0.00000
     13       1.3021      0.00000
     14       3.1803      0.00000
     15      -5.3862      0.00000
     16       3.4508      0.00000
     17       6.4506      0.00000
     18      -6.6464      0.00000
     19      -3.5305      0.00000
     20      -7.5091      0.00000

 k-point 352 :       0.2917    0.0417   -0.1250
  band No.  band energies     occupation 
      1       0.0084      0.00000
      2      -2.8469      0.00000
      3       4.1277      0.00000
      4      -1.4232      0.00000
      5      -5.1008      0.00000
      6       9.3506      0.00000
      7      -2.1698      0.00000
      8       3.6614      0.00000
      9      -8.5124      0.00000
     10      -0.2115      0.00000
     11       3.0774      0.00000
     12      -0.9117      0.00000
     13       0.7086      0.00000
     14      -3.3750      0.00000
     15      -2.6171      0.00000
     16      -0.8390      0.00000
     17       1.0162      0.00000
     18       2.4502      0.00000
     19       0.5285      0.00000
     20       6.2046      0.00000

 k-point 353 :       0.2500   -0.1667   -0.0417
  band No.  band energies     occupation 
      1       0.0100      0.00000
      2      -2.5533      0.00000
      3       3.4126      0.00000
      4      -1.0867      0.00000
      5       9.8570      0.00000
      6      -7.1914      0.00000
      7      -0.1780      0.00000
      8       0.5934      0.00000
      9       7.3142      0.00000
     10     -12.6242      0.00000
     11       2.7702      0.00000
     12      -0.2411      0.00000
     13       0.5404      0.00000
     14      -2.5690      0.00000
     15      -4.9793      0.00000
     16      -2.7442      0.00000
     17       4.0363      0.00000
     18       1.2435      0.00000
     19       4.5540      0.00000
     20       3.4631      0.00000

 k-point 354 :      -0.4167   -0.2500   -0.2917
  band No.  band energies     occupation 
      1      -0.0189      0.00000
      2      -3.7197      0.00000
      3      -3.4536      0.00000
      4      10.2796      0.00000
      5      -7.2987      0.00000
      6       2.2382      0.00000
      7       8.4347      0.00000
      8       0.6386      0.00000
      9      -1.6405      0.00000
     10      -2.8405      0.00000
     11      -2.1854      0.00000
     12      -5.0388      0.00000
     13      -1.3021      0.00000
     14      -3.1803      0.00000
     15       5.3862      0.00000
     16      -3.4508      0.00000
     17      -6.4506      0.00000
     18       6.6464      0.00000
     19       3.5305      0.00000
     20       7.5091      0.00000

 k-point 355 :       0.1667    0.4167    0.1250
  band No.  band energies     occupation 
      1      -0.0084      0.00000
      2       2.8469      0.00000
      3      -4.1277      0.00000
      4       1.4232      0.00000
      5       5.1008      0.00000
      6      -9.3506      0.00000
      7       2.1698      0.00000
      8      -3.6614      0.00000
      9       8.5124      0.00000
     10       0.2115      0.00000
     11      -3.0774      0.00000
     12       0.9117      0.00000
     13      -0.7086      0.00000
     14       3.3750      0.00000
     15       2.6171      0.00000
     16       0.8390      0.00000
     17      -1.0162      0.00000
     18      -2.4502      0.00000
     19      -0.5285      0.00000
     20      -6.2046      0.00000

 k-point 356 :       0.0417   -0.0417    0.2917
  band No.  band energies     occupation 
      1       0.0388      0.00000
      2       3.3414      0.00000
      3       5.1776      0.00000
      4     -10.8120      0.00000
      5       7.1483      0.00000
      6      -5.2394      0.00000
      7      -4.3560      0.00000
      8      -3.1908      0.00000
      9       5.5588      0.00000
     10      -0.3219      0.00000
     11       8.7621      0.00000
     12      -3.7854      0.00000
     13       1.0336      0.00000
     14       2.7086      0.00000
     15      -0.6953      0.00000
     16       4.5376      0.00000
     17       2.2574      0.00000
     18      -6.0138      0.00000
     19      -4.4426      0.00000
     20      -3.8287      0.00000

 k-point 357 :       0.2917    0.0417   -0.0417
  band No.  band energies     occupation 
      1      -0.0245      0.00000
      2      -3.0551      0.00000
      3       3.9465      0.00000
      4      -0.3466      0.00000
      5      -0.4652      0.00000
      6       5.6771      0.00000
      7      -2.2702      0.00000
      8       3.7246      0.00000
      9      -6.2775      0.00000
     10      -3.5620      0.00000
     11      -0.4159      0.00000
     12       1.6540      0.00000
     13      -0.5774      0.00000
     14      -0.5747      0.00000
     15      -3.5997      0.00000
     16      -4.4186      0.00000
     17       0.4022      0.00000
     18       4.1780      0.00000
     19       3.1703      0.00000
     20       6.1504      0.00000

 k-point 358 :       0.2500   -0.0833   -0.0417
  band No.  band energies     occupation 
      1      -0.0172      0.00000
      2      -2.7789      0.00000
      3       6.1057      0.00000
      4      -3.5285      0.00000
      5       8.0154      0.00000
      6      -7.4452      0.00000
      7       2.7126      0.00000
      8       1.3903      0.00000
      9      -1.7710      0.00000
     10      -5.2701      0.00000
     11       1.4994      0.00000
     12       0.4457      0.00000
     13      -4.8358      0.00000
     14       4.6114      0.00000
     15      -7.7559      0.00000
     16       2.1283      0.00000
     17      -3.0016      0.00000
     18       2.7280      0.00000
     19      11.8793      0.00000
     20      -0.4203      0.00000

 k-point 359 :      -0.3333   -0.2500   -0.2917
  band No.  band energies     occupation 
      1      -0.0388      0.00000
      2      -3.3414      0.00000
      3      -5.1776      0.00000
      4      10.8120      0.00000
      5      -7.1483      0.00000
      6       5.2395      0.00000
      7       4.3560      0.00000
      8       3.1908      0.00000
      9      -5.5588      0.00000
     10       0.3219      0.00000
     11      -8.7621      0.00000
     12       3.7854      0.00000
     13      -1.0336      0.00000
     14      -2.7086      0.00000
     15       0.6953      0.00000
     16      -4.5376      0.00000
     17      -2.2575      0.00000
     18       6.0138      0.00000
     19       4.4427      0.00000
     20       3.8286      0.00000

 k-point 360 :       0.0833    0.3333    0.0417
  band No.  band energies     occupation 
      1       0.0245      0.00000
      2       3.0551      0.00000
      3      -3.9465      0.00000
      4       0.3466      0.00000
      5       0.4652      0.00000
      6      -5.6771      0.00000
      7       2.2702      0.00000
      8      -3.7246      0.00000
      9       6.2775      0.00000
     10       3.5620      0.00000
     11       0.4159      0.00000
     12      -1.6540      0.00000
     13       0.5774      0.00000
     14       0.5747      0.00000
     15       3.5996      0.00000
     16       4.4186      0.00000
     17      -0.4022      0.00000
     18      -4.1780      0.00000
     19      -3.1702      0.00000
     20      -6.1504      0.00000

 k-point 361 :       0.0417    0.3750    0.3750
  band No.  band energies     occupation 
      1       0.0020      0.00000
      2       0.0272      0.00000
      3      -5.4337      0.00000
      4       5.4268      0.00000
      5       0.3697      0.00000
      6      -0.3630      0.00000
      7      -7.9231      0.00000
      8       7.7002      0.00000
      9       1.4901      0.00000
     10      -1.3846      0.00000
     11       1.6736      0.00000
     12      -6.9243      0.00000
     13       6.5290      0.00000
     14      -0.0125      0.00000
     15      -7.4863      0.00000
     16       6.2540      0.00000
     17       0.3679      0.00000
     18      -0.3499      0.00000
     19       0.4976      0.00000
     20       0.4771      0.00000

 k-point 362 :       0.3333    0.3333   -0.0417
  band No.  band energies     occupation 
      1      -0.0090      0.00000
      2       1.6888      0.00000
      3      -2.0932      0.00000
      4       0.1405      0.00000
      5       0.5910      0.00000
      6      -0.5512      0.00000
      7      -1.2556      0.00000
      8       0.5424      0.00000
      9      -1.2531      0.00000
     10       1.5238      0.00000
     11       6.3745      0.00000
     12      -1.0834      0.00000
     13      -3.8339      0.00000
     14      -2.2835      0.00000
     15      -0.1170      0.00000
     16       3.7316      0.00000
     17      -2.2244      0.00000
     18      -0.7454      0.00000
     19      -0.5540      0.00000
     20       9.0366      0.00000

 k-point 363 :       0.0000   -0.3333   -0.3750
  band No.  band energies     occupation 
      1      -0.0020      0.00000
      2      -0.0272      0.00000
      3       5.4337      0.00000
      4      -5.4268      0.00000
      5      -0.3697      0.00000
      6       0.3630      0.00000
      7       7.9231      0.00000
      8      -7.7002      0.00000
      9      -1.4901      0.00000
     10       1.3846      0.00000
     11      -1.6736      0.00000
     12       6.9243      0.00000
     13      -6.5290      0.00000
     14       0.0125      0.00000
     15       7.4863      0.00000
     16      -6.2540      0.00000
     17      -0.3679      0.00000
     18       0.3499      0.00000
     19      -0.4976      0.00000
     20      -0.4771      0.00000

 k-point 364 :       0.0417    0.4583    0.3750
  band No.  band energies     occupation 
      1      -0.0168      0.00000
      2      -0.0673      0.00000
      3       4.9665      0.00000
      4      -4.9782      0.00000
      5      -1.4091      0.00000
      6       1.4238      0.00000
      7       1.5282      0.00000
      8      -0.7141      0.00000
      9     -11.8833      0.00000
     10      11.7044      0.00000
     11      -4.9513      0.00000
     12       4.5759      0.00000
     13      -0.5745      0.00000
     14       0.4979      0.00000
     15       3.4337      0.00000
     16       0.9251      0.00000
     17      -5.6610      0.00000
     18       1.3094      0.00000
     19      -1.3811      0.00000
     20       1.7477      0.00000

 k-point 365 :       0.3750    0.0417    0.4583
  band No.  band energies     occupation 
      1      -0.0368      0.00000
      2       1.1011      0.00000
      3      -2.5010      0.00000
      4       1.3126      0.00000
      5       0.5001      0.00000
      6      -0.5434      0.00000
      7      -0.8818      0.00000
      8       0.3420      0.00000
      9      -2.7529      0.00000
     10       2.8094      0.00000
     11       3.6653      0.00000
     12      -1.3324      0.00000
     13       0.9853      0.00000
     14      -2.1783      0.00000
     15      -1.9012      0.00000
     16      -2.2042      0.00000
     17       3.5372      0.00000
     18      -0.3675      0.00000
     19       1.4992      0.00000
     20       0.9702      0.00000

 k-point 366 :       0.3333    0.4167   -0.0417
  band No.  band energies     occupation 
      1      -0.0965      0.00000
      2       2.6018      0.00000
      3      -1.6973      0.00000
      4      -1.2999      0.00000
      5       1.6033      0.00000
      6      -1.6514      0.00000
      7       0.0029      0.00000
      8      -1.7823      0.00000
      9      -3.6343      0.00000
     10       4.3004      0.00000
     11       8.1978      0.00000
     12      -0.6713      0.00000
     13      -0.4798      0.00000
     14      -5.4348      0.00000
     15      -0.4938      0.00000
     16      -6.3179      0.00000
     17       6.5142      0.00000
     18      -1.5449      0.00000
     19       8.4346      0.00000
     20      -0.7997      0.00000

 k-point 367 :       0.0833   -0.3333   -0.3750
  band No.  band energies     occupation 
      1       0.0168      0.00000
      2       0.0673      0.00000
      3      -4.9665      0.00000
      4       4.9782      0.00000
      5       1.4091      0.00000
      6      -1.4238      0.00000
      7      -1.5282      0.00000
      8       0.7141      0.00000
      9      11.8833      0.00000
     10     -11.7044      0.00000
     11       4.9513      0.00000
     12      -4.5759      0.00000
     13       0.5745      0.00000
     14      -0.4979      0.00000
     15      -3.4337      0.00000
     16      -0.9251      0.00000
     17       5.6610      0.00000
     18      -1.3094      0.00000
     19       1.3811      0.00000
     20      -1.7477      0.00000

 k-point 368 :      -0.4167   -0.0833   -0.4583
  band No.  band energies     occupation 
      1       0.0368      0.00000
      2      -1.1011      0.00000
      3       2.5010      0.00000
      4      -1.3126      0.00000
      5      -0.5001      0.00000
      6       0.5434      0.00000
      7       0.8818      0.00000
      8      -0.3420      0.00000
      9       2.7529      0.00000
     10      -2.8094      0.00000
     11      -3.6653      0.00000
     12       1.3324      0.00000
     13      -0.9853      0.00000
     14       2.1783      0.00000
     15       1.9012      0.00000
     16       2.2042      0.00000
     17      -3.5372      0.00000
     18       0.3675      0.00000
     19      -1.4992      0.00000
     20      -0.9702      0.00000

 k-point 369 :       0.0417   -0.4583    0.3750
  band No.  band energies     occupation 
      1      -0.2729      0.00000
      2       0.1656      0.00000
      3       5.0401      0.00000
      4      -5.4027      0.00000
      5      -4.5379      0.00000
      6       4.5638      0.00000
      7       6.2920      0.00000
      8      -2.2679      0.00000
      9     -12.6269      0.00000
     10      11.4303      0.00000
     11      -7.5505      0.00000
     12       3.8157      0.00000
     13       2.5706      0.00000
     14       2.7274      0.00000
     15      -6.6787      0.00000
     16       5.8545      0.00000
     17       4.0824      0.00000
     18      -0.1798      0.00000
     19      -7.9456      0.00000
     20       3.4940      0.00000

 k-point 370 :       0.3750    0.0417   -0.4583
  band No.  band energies     occupation 
      1      -0.3661      0.00000
      2       2.6282      0.00000
      3      -3.1800      0.00000
      4       0.8146      0.00000
      5       0.6582      0.00000
      6      -0.9283      0.00000
      7      -2.7728      0.00000
      8       2.0609      0.00000
      9      -1.6110      0.00000
     10       1.2451      0.00000
     11       3.7703      0.00000
     12      -0.4027      0.00000
     13       3.8970      0.00000
     14      -4.6086      0.00000
     15      -4.9652      0.00000
     16      -2.7420      0.00000
     17       4.6751      0.00000
     18      -1.4887      0.00000
     19       5.8384      0.00000
     20       1.9863      0.00000

 k-point 371 :       0.3333   -0.5000   -0.0417
  band No.  band energies     occupation 
      1      -0.4945      0.00000
      2       3.2204      0.00000
      3      -2.6809      0.00000
      4      -0.3607      0.00000
      5       0.9747      0.00000
      6      -1.3056      0.00000
      7      -0.1584      0.00000
      8      -2.0995      0.00000
      9       2.0455      0.00000
     10      -1.0795      0.00000
     11       4.4666      0.00000
     12      -0.5744      0.00000
     13       5.1804      0.00000
     14      -5.0585      0.00000
     15      -5.3638      0.00000
     16      -3.1482      0.00000
     17       2.4631      0.00000
     18       1.9969      0.00000
     19       7.0644      0.00000
     20       0.0053      0.00000

 k-point 372 :      -0.8333   -0.3333   -0.3750
  band No.  band energies     occupation 
      1       0.2729      0.00000
      2      -0.1656      0.00000
      3      -5.0401      0.00000
      4       5.4027      0.00000
      5       4.5379      0.00000
      6      -4.5638      0.00000
      7      -6.2920      0.00000
      8       2.2679      0.00000
      9      12.6269      0.00000
     10     -11.4303      0.00000
     11       7.5505      0.00000
     12      -3.8157      0.00000
     13      -2.5706      0.00000
     14      -2.7274      0.00000
     15       6.6787      0.00000
     16      -5.8545      0.00000
     17      -4.0824      0.00000
     18       0.1798      0.00000
     19       7.9456      0.00000
     20      -3.4940      0.00000

 k-point 373 :       0.5000    0.8333    0.4583
  band No.  band energies     occupation 
      1       0.3661      0.00000
      2      -2.6282      0.00000
      3       3.1800      0.00000
      4      -0.8146      0.00000
      5      -0.6582      0.00000
      6       0.9283      0.00000
      7       2.7728      0.00000
      8      -2.0609      0.00000
      9       1.6110      0.00000
     10      -1.2451      0.00000
     11      -3.7703      0.00000
     12       0.4027      0.00000
     13      -3.8970      0.00000
     14       4.6086      0.00000
     15       4.9652      0.00000
     16       2.7420      0.00000
     17      -4.6751      0.00000
     18       1.4887      0.00000
     19      -5.8384      0.00000
     20      -1.9863      0.00000

 k-point 374 :       0.0417   -0.3750    0.3750
  band No.  band energies     occupation 
      1      -2.7662      0.00000
      2       3.5945      0.00000
      3       4.0357      0.00000
      4      -5.8197      0.00000
      5      -5.0924      0.00000
      6       4.6843      0.00000
      7      10.0301      0.00000
      8      -1.9846      0.00000
      9      -9.7705      0.00000
     10       4.5061      0.00000
     11      -4.9604      0.00000
     12       1.5951      0.00000
     13       2.3020      0.00000
     14       3.7263      0.00000
     15       2.7025      0.00000
     16      -9.7725      0.00000
     17       3.2908      0.00000
     18      12.6676      0.00000
     19       4.4552      0.00000
     20      -0.7170      0.00000

 k-point 375 :       0.3750    0.0417   -0.3750
  band No.  band energies     occupation 
      1      -1.3842      0.00000
      2       3.3039      0.00000
      3      -2.2367      0.00000
      4       0.2988      0.00000
      5       0.2352      0.00000
      6      -0.5640      0.00000
      7      -1.7644      0.00000
      8       1.7509      0.00000
      9      -0.7160      0.00000
     10       0.4566      0.00000
     11       1.2378      0.00000
     12       0.1292      0.00000
     13       1.7366      0.00000
     14      -2.2923      0.00000
     15       4.0961      0.00000
     16      -2.9096      0.00000
     17      -2.0002      0.00000
     18      -3.0344      0.00000
     19       2.0528      0.00000
     20       3.5232      0.00000

 k-point 376 :       0.3333   -0.4167   -0.0417
  band No.  band energies     occupation 
      1      -1.4782      0.00000
      2       3.3801      0.00000
      3      -1.9445      0.00000
      4      -0.0452      0.00000
      5       0.1756      0.00000
      6      -0.4917      0.00000
      7      -0.2739      0.00000
      8      -1.2022      0.00000
      9       1.6992      0.00000
     10      -0.8481      0.00000
     11       1.5556      0.00000
     12      -0.5337      0.00000
     13       2.7775      0.00000
     14      -1.5025      0.00000
     15       3.5633      0.00000
     16      -2.4354      0.00000
     17      -3.0875      0.00000
     18      -3.5025      0.00000
     19       2.1984      0.00000
     20       5.0690      0.00000

 k-point 377 :      -0.7500   -0.3333   -0.3750
  band No.  band energies     occupation 
      1       2.7662      0.00000
      2      -3.5945      0.00000
      3      -4.0357      0.00000
      4       5.8197      0.00000
      5       5.0924      0.00000
      6      -4.6843      0.00000
      7     -10.0301      0.00000
      8       1.9846      0.00000
      9       9.7705      0.00000
     10      -4.5061      0.00000
     11       4.9604      0.00000
     12      -1.5951      0.00000
     13      -2.3020      0.00000
     14      -3.7263      0.00000
     15      -2.7025      0.00000
     16       9.7725      0.00000
     17      -3.2908      0.00000
     18     -12.6676      0.00000
     19      -4.4552      0.00000
     20       0.7170      0.00000

 k-point 378 :       0.4167    0.7500    0.3750
  band No.  band energies     occupation 
      1       1.3842      0.00000
      2      -3.3039      0.00000
      3       2.2367      0.00000
      4      -0.2988      0.00000
      5      -0.2352      0.00000
      6       0.5640      0.00000
      7       1.7644      0.00000
      8      -1.7509      0.00000
      9       0.7160      0.00000
     10      -0.4566      0.00000
     11      -1.2378      0.00000
     12      -0.1292      0.00000
     13      -1.7366      0.00000
     14       2.2923      0.00000
     15      -4.0961      0.00000
     16       2.9096      0.00000
     17       2.0002      0.00000
     18       3.0344      0.00000
     19      -2.0528      0.00000
     20      -3.5232      0.00000

 k-point 379 :       0.0417   -0.2917    0.3750
  band No.  band energies     occupation 
      1      -1.5866      0.00000
      2       4.5231      0.00000
      3       2.1552      0.00000
      4      -6.5487      0.00000
      5      -5.5257      0.00000
      6      11.6438      0.00000
      7      -0.8238      0.00000
      8       0.6157      0.00000
      9      -3.9739      0.00000
     10      -6.2984      0.00000
     11       2.6373      0.00000
     12       1.4469      0.00000
     13       5.4803      0.00000
     14      -0.0345      0.00000
     15       3.9486      0.00000
     16       4.9394      0.00000
     17      -3.4145      0.00000
     18       3.8054      0.00000
     19       4.9738      0.00000
     20      -9.7906      0.00000

 k-point 380 :       0.3750    0.0417   -0.2917
  band No.  band energies     occupation 
      1       0.5035      0.00000
      2      -2.8669      0.00000
      3       2.7086      0.00000
      4      -0.3528      0.00000
      5      -0.3032      0.00000
      6       2.7554      0.00000
      7      -0.6472      0.00000
      8      -0.2956      0.00000
      9      -0.4129      0.00000
     10      -1.7025      0.00000
     11       0.1917      0.00000
     12      -0.0767      0.00000
     13       1.3142      0.00000
     14      -2.0522      0.00000
     15      -6.3968      0.00000
     16       6.0496      0.00000
     17       2.0548      0.00000
     18       0.2983      0.00000
     19       1.2893      0.00000
     20      -5.9006      0.00000

 k-point 381 :       0.3333   -0.3333   -0.0417
  band No.  band energies     occupation 
      1       0.5010      0.00000
      2      -2.6571      0.00000
      3       2.2324      0.00000
      4      -0.0192      0.00000
      5      -0.0416      0.00000
      6       0.9012      0.00000
      7      -0.5346      0.00000
      8       3.2349      0.00000
      9      -3.3778      0.00000
     10      -0.3392      0.00000
     11      -0.1907      0.00000
     12       1.0607      0.00000
     13      -0.6936      0.00000
     14      -2.6980      0.00000
     15      -5.7846      0.00000
     16       6.2649      0.00000
     17       4.3904      0.00000
     18      -2.2562      0.00000
     19       1.3315      0.00000
     20      -3.5823      0.00000

 k-point 382 :      -0.6667   -0.3333   -0.3750
  band No.  band energies     occupation 
      1       1.5866      0.00000
      2      -4.5231      0.00000
      3      -2.1552      0.00000
      4       6.5487      0.00000
      5       5.5257      0.00000
      6     -11.6438      0.00000
      7       0.8238      0.00000
      8      -0.6157      0.00000
      9       3.9739      0.00000
     10       6.2984      0.00000
     11      -2.6373      0.00000
     12      -1.4469      0.00000
     13      -5.4803      0.00000
     14       0.0345      0.00000
     15      -3.9486      0.00000
     16      -4.9394      0.00000
     17       3.4145      0.00000
     18      -3.8054      0.00000
     19      -4.9738      0.00000
     20       9.7906      0.00000

 k-point 383 :       0.3333    0.6667    0.2917
  band No.  band energies     occupation 
      1      -0.5035      0.00000
      2       2.8669      0.00000
      3      -2.7086      0.00000
      4       0.3528      0.00000
      5       0.3032      0.00000
      6      -2.7554      0.00000
      7       0.6472      0.00000
      8       0.2956      0.00000
      9       0.4129      0.00000
     10       1.7025      0.00000
     11      -0.1917      0.00000
     12       0.0767      0.00000
     13      -1.3142      0.00000
     14       2.0522      0.00000
     15       6.3968      0.00000
     16      -6.0496      0.00000
     17      -2.0548      0.00000
     18      -0.2983      0.00000
     19      -1.2893      0.00000
     20       5.9006      0.00000

 k-point 384 :       0.0417   -0.2083    0.3750
  band No.  band energies     occupation 
      1      -0.6296      0.00000
      2       3.5284      0.00000
      3       2.8459      0.00000
      4      -7.6442      0.00000
      5      -6.2897      0.00000
      6      10.2941      0.00000
      7      -4.6274      0.00000
      8      -4.7518      0.00000
      9       8.7921      0.00000
     10      -5.3886      0.00000
     11       0.0714      0.00000
     12       5.3690      0.00000
     13       1.1617      0.00000
     14       0.2511      0.00000
     15       7.4431      0.00000
     16       0.5608      0.00000
     17       7.7621      0.00000
     18      -4.1322      0.00000
     19      -6.9575      0.00000
     20      -3.8361      0.00000

 k-point 385 :       0.3750    0.0417   -0.2083
  band No.  band energies     occupation 
      1       0.4237      0.00000
      2      -3.0331      0.00000
      3       3.7954      0.00000
      4      -1.2861      0.00000
      5      -1.6004      0.00000
      6       6.4859      0.00000
      7      -5.0616      0.00000
      8       9.7180      0.00000
      9      -7.2705      0.00000
     10      -4.7886      0.00000
     11       1.9459      0.00000
     12       0.0044      0.00000
     13      -0.3141      0.00000
     14      -3.0319      0.00000
     15      -5.0028      0.00000
     16       3.9858      0.00000
     17       5.6986      0.00000
     18      -3.0810      0.00000
     19       5.7492      0.00000
     20       0.3345      0.00000

 k-point 386 :       0.3333   -0.2500   -0.0417
  band No.  band energies     occupation 
      1       0.4126      0.00000
      2      -2.8032      0.00000
      3       2.7096      0.00000
      4      -0.2559      0.00000
      5       0.5041      0.00000
      6       1.6619      0.00000
      7      -0.0184      0.00000
      8       4.8739      0.00000
      9      -6.0898      0.00000
     10      -3.1379      0.00000
     11       1.6809      0.00000
     12       2.3277      0.00000
     13      -3.9657      0.00000
     14      -4.1987      0.00000
     15      -4.2956      0.00000
     16       4.0037      0.00000
     17       7.1023      0.00000
     18       1.8754      0.00000
     19      -1.7197      0.00000
     20       2.1363      0.00000

 k-point 387 :      -0.5833   -0.3333   -0.3750
  band No.  band energies     occupation 
      1       0.6296      0.00000
      2      -3.5284      0.00000
      3      -2.8459      0.00000
      4       7.6442      0.00000
      5       6.2897      0.00000
      6     -10.2941      0.00000
      7       4.6274      0.00000
      8       4.7518      0.00000
      9      -8.7921      0.00000
     10       5.3886      0.00000
     11      -0.0714      0.00000
     12      -5.3690      0.00000
     13      -1.1617      0.00000
     14      -0.2511      0.00000
     15      -7.4431      0.00000
     16      -0.5608      0.00000
     17      -7.7621      0.00000
     18       4.1322      0.00000
     19       6.9575      0.00000
     20       3.8361      0.00000

 k-point 388 :       0.2500    0.5833    0.2083
  band No.  band energies     occupation 
      1      -0.4237      0.00000
      2       3.0331      0.00000
      3      -3.7954      0.00000
      4       1.2861      0.00000
      5       1.6004      0.00000
      6      -6.4859      0.00000
      7       5.0616      0.00000
      8      -9.7180      0.00000
      9       7.2705      0.00000
     10       4.7886      0.00000
     11      -1.9459      0.00000
     12      -0.0044      0.00000
     13       0.3141      0.00000
     14       3.0319      0.00000
     15       5.0028      0.00000
     16      -3.9858      0.00000
     17      -5.6986      0.00000
     18       3.0810      0.00000
     19      -5.7492      0.00000
     20      -0.3345      0.00000

 k-point 389 :       0.0417   -0.1250    0.3750
  band No.  band energies     occupation 
      1      -0.2368      0.00000
      2       2.9790      0.00000
      3       4.1856      0.00000
      4      -9.0216      0.00000
      5      -7.2766      0.00000
      6      10.0911      0.00000
      7      -5.2045      0.00000
      8      -4.2306      0.00000
      9       8.9019      0.00000
     10      -3.4067      0.00000
     11      -1.1934      0.00000
     12       9.6598      0.00000
     13      -0.2104      0.00000
     14      -2.4090      0.00000
     15       9.0604      0.00000
     16      -2.5908      0.00000
     17      10.5479      0.00000
     18      -3.6966      0.00000
     19     -10.3642      0.00000
     20     -11.0696      0.00000

 k-point 390 :       0.3750    0.0417   -0.1250
  band No.  band energies     occupation 
      1       0.2170      0.00000
      2      -2.6809      0.00000
      3       4.7172      0.00000
      4      -2.4327      0.00000
      5      -8.0120      0.00000
      6      14.4111      0.00000
      7      -2.7899      0.00000
      8       6.4613      0.00000
      9      -8.7347      0.00000
     10      -5.8340      0.00000
     11       4.4028      0.00000
     12      -0.8426      0.00000
     13      -2.9234      0.00000
     14      -2.9860      0.00000
     15      -2.4864      0.00000
     16       0.4748      0.00000
     17       1.8453      0.00000
     18       7.0282      0.00000
     19      -3.8967      0.00000
     20       7.8628      0.00000

 k-point 391 :       0.3333   -0.1667   -0.0417
  band No.  band energies     occupation 
      1       0.2105      0.00000
      2      -2.5033      0.00000
      3       3.0818      0.00000
      4      -0.8418      0.00000
      5       5.6886      0.00000
      6      -2.4422      0.00000
      7       0.4102      0.00000
      8       2.5966      0.00000
      9      -4.2359      0.00000
     10      -5.7885      0.00000
     11       3.6653      0.00000
     12       0.9039      0.00000
     13      -1.6549      0.00000
     14      -5.7135      0.00000
     15      -4.9209      0.00000
     16      -0.9263      0.00000
     17       7.1783      0.00000
     18       3.0859      0.00000
     19       9.4916      0.00000
     20      -1.7132      0.00000

 k-point 392 :      -0.5000   -0.3333   -0.3750
  band No.  band energies     occupation 
      1       0.2368      0.00000
      2      -2.9790      0.00000
      3      -4.1856      0.00000
      4       9.0216      0.00000
      5       7.2766      0.00000
      6     -10.0911      0.00000
      7       5.2045      0.00000
      8       4.2306      0.00000
      9      -8.9019      0.00000
     10       3.4067      0.00000
     11       1.1934      0.00000
     12      -9.6598      0.00000
     13       0.2104      0.00000
     14       2.4090      0.00000
     15      -9.0604      0.00000
     16       2.5908      0.00000
     17     -10.5479      0.00000
     18       3.6966      0.00000
     19      10.3642      0.00000
     20      11.0696      0.00000

 k-point 393 :       0.1667    0.5000    0.1250
  band No.  band energies     occupation 
      1      -0.2170      0.00000
      2       2.6809      0.00000
      3      -4.7172      0.00000
      4       2.4327      0.00000
      5       8.0120      0.00000
      6     -14.4111      0.00000
      7       2.7899      0.00000
      8      -6.4613      0.00000
      9       8.7347      0.00000
     10       5.8340      0.00000
     11      -4.4028      0.00000
     12       0.8426      0.00000
     13       2.9234      0.00000
     14       2.9860      0.00000
     15       2.4864      0.00000
     16      -0.4748      0.00000
     17      -1.8453      0.00000
     18      -7.0282      0.00000
     19       3.8967      0.00000
     20      -7.8628      0.00000

 k-point 394 :       0.0417   -0.0417    0.3750
  band No.  band energies     occupation 
      1      -0.0775      0.00000
      2       2.7100      0.00000
      3       5.8805      0.00000
      4      -9.9809      0.00000
      5       4.6348      0.00000
      6      -4.8804      0.00000
      7      -3.3759      0.00000
      8      -4.8894      0.00000
      9       8.0336      0.00000
     10      -1.6280      0.00000
     11       3.5447      0.00000
     12       4.2548      0.00000
     13       2.3115      0.00000
     14      -1.9514      0.00000
     15       8.9304      0.00000
     16      -4.8783      0.00000
     17       6.5473      0.00000
     18      -7.0114      0.00000
     19      -9.8572      0.00000
     20      -4.3929      0.00000

 k-point 395 :       0.3750    0.0417   -0.0417
  band No.  band energies     occupation 
      1       0.0826      0.00000
      2      -2.5882      0.00000
      3       4.7404      0.00000
      4      -1.9735      0.00000
      5      -3.3360      0.00000
      6      10.1387      0.00000
      7      -2.4487      0.00000
      8       5.3707      0.00000
      9      -8.5886      0.00000
     10      -4.9446      0.00000
     11       2.8743      0.00000
     12      -1.7510      0.00000
     13      -2.3780      0.00000
     14      -1.2565      0.00000
     15      -4.0224      0.00000
     16      -1.8697      0.00000
     17      -0.6088      0.00000
     18       5.9789      0.00000
     19       1.3381      0.00000
     20      10.9779      0.00000

 k-point 396 :       0.3333   -0.0833   -0.0417
  band No.  band energies     occupation 
      1       0.0838      0.00000
      2      -2.4340      0.00000
      3       5.1581      0.00000
      4      -2.8993      0.00000
      5      11.7751      0.00000
      6      -9.6027      0.00000
      7       2.0642      0.00000
      8       2.8683      0.00000
      9      -4.9168      0.00000
     10      -5.5971      0.00000
     11       3.3129      0.00000
     12      -0.9905      0.00000
     13       1.3061      0.00000
     14      -6.4793      0.00000
     15      -5.5953      0.00000
     16      -5.8288      0.00000
     17       7.3368      0.00000
     18       3.9175      0.00000
     19       5.0657      0.00000
     20       8.6291      0.00000

 k-point 397 :      -0.4167   -0.3333   -0.3750
  band No.  band energies     occupation 
      1       0.0775      0.00000
      2      -2.7100      0.00000
      3      -5.8805      0.00000
      4       9.9809      0.00000
      5      -4.6348      0.00000
      6       4.8804      0.00000
      7       3.3759      0.00000
      8       4.8894      0.00000
      9      -8.0336      0.00000
     10       1.6280      0.00000
     11      -3.5447      0.00000
     12      -4.2548      0.00000
     13      -2.3115      0.00000
     14       1.9514      0.00000
     15      -8.9304      0.00000
     16       4.8783      0.00000
     17      -6.5473      0.00000
     18       7.0114      0.00000
     19       9.8572      0.00000
     20       4.3929      0.00000

 k-point 398 :       0.0833    0.4167    0.0417
  band No.  band energies     occupation 
      1      -0.0826      0.00000
      2       2.5882      0.00000
      3      -4.7404      0.00000
      4       1.9735      0.00000
      5       3.3360      0.00000
      6     -10.1387      0.00000
      7       2.4487      0.00000
      8      -5.3707      0.00000
      9       8.5886      0.00000
     10       4.9446      0.00000
     11      -2.8743      0.00000
     12       1.7510      0.00000
     13       2.3780      0.00000
     14       1.2565      0.00000
     15       4.0224      0.00000
     16       1.8697      0.00000
     17       0.6088      0.00000
     18      -5.9789      0.00000
     19      -1.3381      0.00000
     20     -10.9779      0.00000

 k-point 399 :       0.0417    0.4583    0.4583
  band No.  band energies     occupation 
      1       0.0115      0.00000
      2       0.0092      0.00000
      3      -5.0389      0.00000
      4       5.0631      0.00000
      5       0.7914      0.00000
      6      -0.8117      0.00000
      7      -9.5786      0.00000
      8       9.2050      0.00000
      9       6.6409      0.00000
     10      -6.7068      0.00000
     11      10.6728      0.00000
     12     -10.8757      0.00000
     13       0.1649      0.00000
     14       0.9873      0.00000
     15       2.8261      0.00000
     16      -9.3047      0.00000
     17       6.4798      0.00000
     18      -0.6881      0.00000
     19       3.3196      0.00000
     20      -6.3276      0.00000

 k-point 400 :       0.4167    0.4167   -0.0417
  band No.  band energies     occupation 
      1      -0.0648      0.00000
      2       0.4456      0.00000
      3      -0.5398      0.00000
      4       0.0587      0.00000
      5       0.5495      0.00000
      6      -0.5441      0.00000
      7      -0.7068      0.00000
      8       0.3214      0.00000
      9      -2.2228      0.00000
     10       2.2812      0.00000
     11       2.1073      0.00000
     12      -0.0706      0.00000
     13       0.7003      0.00000
     14      -1.7554      0.00000
     15      -6.1883      0.00000
     16      -1.4612      0.00000
     17       7.1907      0.00000
     18       0.2001      0.00000
     19       3.7375      0.00000
     20       1.0945      0.00000

 k-point 401 :       0.0000   -0.4167   -0.4583
  band No.  band energies     occupation 
      1      -0.0115      0.00000
      2      -0.0092      0.00000
      3       5.0389      0.00000
      4      -5.0631      0.00000
      5      -0.7914      0.00000
      6       0.8117      0.00000
      7       9.5786      0.00000
      8      -9.2051      0.00000
      9      -6.6409      0.00000
     10       6.7068      0.00000
     11     -10.6728      0.00000
     12      10.8757      0.00000
     13      -0.1649      0.00000
     14      -0.9873      0.00000
     15      -2.8261      0.00000
     16       9.3047      0.00000
     17      -6.4798      0.00000
     18       0.6881      0.00000
     19      -3.3196      0.00000
     20       6.3276      0.00000

 k-point 402 :       0.0417   -0.4583    0.4583
  band No.  band energies     occupation 
      1      -0.1290      0.00000
      2       0.0878      0.00000
      3       4.9552      0.00000
      4      -5.0455      0.00000
      5      -3.8082      0.00000
      6       3.8666      0.00000
      7       6.4927      0.00000
      8      -5.3617      0.00000
      9     -16.0414      0.00000
     10      16.2231      0.00000
     11      -9.8447      0.00000
     12       8.8066      0.00000
     13       4.0126      0.00000
     14      -5.7453      0.00000
     15      -0.4379      0.00000
     16       1.8241      0.00000
     17       4.1993      0.00000
     18      -2.6156      0.00000
     19      -2.4158      0.00000
     20       2.1811      0.00000

 k-point 403 :       0.4583    0.0417   -0.4583
  band No.  band energies     occupation 
      1      -0.1544      0.00000
      2       0.2946      0.00000
      3      -0.3695      0.00000
      4       0.2079      0.00000
      5       0.2899      0.00000
      6      -0.3044      0.00000
      7      -0.8341      0.00000
      8       0.7460      0.00000
      9      -0.8939      0.00000
     10       0.8274      0.00000
     11       0.8061      0.00000
     12      -0.3034      0.00000
     13       1.6268      0.00000
     14      -1.8580      0.00000
     15      -2.7822      0.00000
     16       0.2899      0.00000
     17       2.3800      0.00000
     18       4.1676      0.00000
     19      -5.2168      0.00000
     20       2.8003      0.00000

 k-point 404 :       0.4167   -0.5000   -0.0417
  band No.  band energies     occupation 
      1      -0.4061      0.00000
      2       0.7604      0.00000
      3      -0.3007      0.00000
      4      -0.1423      0.00000
      5       0.8863      0.00000
      6      -0.9015      0.00000
      7       0.7973      0.00000
      8      -1.2873      0.00000
      9      -0.4274      0.00000
     10       0.5810      0.00000
     11       1.4658      0.00000
     12      -0.1511      0.00000
     13       4.0968      0.00000
     14      -4.3680      0.00000
     15     -10.4744      0.00000
     16       8.6959      0.00000
     17       2.3481      0.00000
     18       9.7908      0.00000
     19      -1.4561      0.00000
     20      -6.4435      0.00000

 k-point 405 :      -0.9167   -0.4167   -0.4583
  band No.  band energies     occupation 
      1       0.1290      0.00000
      2      -0.0878      0.00000
      3      -4.9552      0.00000
      4       5.0455      0.00000
      5       3.8082      0.00000
      6      -3.8666      0.00000
      7      -6.4927      0.00000
      8       5.3617      0.00000
      9      16.0414      0.00000
     10     -16.2231      0.00000
     11       9.8447      0.00000
     12      -8.8066      0.00000
     13      -4.0126      0.00000
     14       5.7453      0.00000
     15       0.4379      0.00000
     16      -1.8241      0.00000
     17      -4.1993      0.00000
     18       2.6156      0.00000
     19       2.4158      0.00000
     20      -2.1811      0.00000

 k-point 406 :       0.5000    0.9167    0.4583
  band No.  band energies     occupation 
      1       0.1544      0.00000
      2      -0.2946      0.00000
      3       0.3695      0.00000
      4      -0.2079      0.00000
      5      -0.2899      0.00000
      6       0.3044      0.00000
      7       0.8341      0.00000
      8      -0.7460      0.00000
      9       0.8939      0.00000
     10      -0.8274      0.00000
     11      -0.8061      0.00000
     12       0.3034      0.00000
     13      -1.6268      0.00000
     14       1.8580      0.00000
     15       2.7822      0.00000
     16      -0.2899      0.00000
     17      -2.3800      0.00000
     18      -4.1676      0.00000
     19       5.2168      0.00000
     20      -2.8003      0.00000

 k-point 407 :       0.0417   -0.3750    0.4583
  band No.  band energies     occupation 
      1      -0.9306      0.00000
      2       0.7943      0.00000
      3       4.9538      0.00000
      4      -5.3308      0.00000
      5      -4.7037      0.00000
      6       4.7880      0.00000
      7       9.4687      0.00000
      8      -4.8544      0.00000
      9     -12.6751      0.00000
     10      11.4616      0.00000
     11      -8.0682      0.00000
     12       4.3684      0.00000
     13       4.8956      0.00000
     14      -2.3589      0.00000
     15      -6.6925      0.00000
     16       1.5303      0.00000
     17       9.1019      0.00000
     18       1.0711      0.00000
     19       4.4765      0.00000
     20      -3.8005      0.00000

 k-point 408 :       0.4583    0.0417   -0.3750
  band No.  band energies     occupation 
      1       0.7023      0.00000
      2      -1.3985      0.00000
      3       0.9800      0.00000
      4      -0.2511      0.00000
      5      -0.2355      0.00000
      6       0.3262      0.00000
      7       1.5569      0.00000
      8      -1.4094      0.00000
      9       0.7395      0.00000
     10      -0.4759      0.00000
     11      -1.2620      0.00000
     12       0.0477      0.00000
     13      -2.1883      0.00000
     14       5.0788      0.00000
     15       1.1737      0.00000
     16      -4.1268      0.00000
     17       2.5723      0.00000
     18       1.6373      0.00000
     19      -2.7828      0.00000
     20      -4.0606      0.00000

 k-point 409 :       0.4167   -0.4167   -0.0417
  band No.  band energies     occupation 
      1       0.9316      0.00000
      2      -1.7928      0.00000
      3       0.8680      0.00000
      4       0.0953      0.00000
      5      -0.3438      0.00000
      6       0.4497      0.00000
      7      -0.1104      0.00000
      8       1.0313      0.00000
      9      -0.9057      0.00000
     10       0.5104      0.00000
     11      -1.4957      0.00000
     12       0.1077      0.00000
     13      -3.2131      0.00000
     14       3.0014      0.00000
     15       7.8268      0.00000
     16      -8.9310      0.00000
     17       2.0961      0.00000
     18       3.5965      0.00000
     19      -0.6602      0.00000
     20      -9.0978      0.00000

 k-point 410 :      -0.8333   -0.4167   -0.4583
  band No.  band energies     occupation 
      1       0.9306      0.00000
      2      -0.7943      0.00000
      3      -4.9538      0.00000
      4       5.3308      0.00000
      5       4.7037      0.00000
      6      -4.7880      0.00000
      7      -9.4687      0.00000
      8       4.8544      0.00000
      9      12.6751      0.00000
     10     -11.4616      0.00000
     11       8.0682      0.00000
     12      -4.3684      0.00000
     13      -4.8956      0.00000
     14       2.3589      0.00000
     15       6.6925      0.00000
     16      -1.5303      0.00000
     17      -9.1019      0.00000
     18      -1.0711      0.00000
     19      -4.4765      0.00000
     20       3.8005      0.00000

 k-point 411 :       0.4167    0.8333    0.3750
  band No.  band energies     occupation 
      1      -0.7023      0.00000
      2       1.3985      0.00000
      3      -0.9800      0.00000
      4       0.2511      0.00000
      5       0.2355      0.00000
      6      -0.3262      0.00000
      7      -1.5569      0.00000
      8       1.4094      0.00000
      9      -0.7395      0.00000
     10       0.4759      0.00000
     11       1.2620      0.00000
     12      -0.0477      0.00000
     13       2.1883      0.00000
     14      -5.0788      0.00000
     15      -1.1737      0.00000
     16       4.1268      0.00000
     17      -2.5723      0.00000
     18      -1.6373      0.00000
     19       2.7828      0.00000
     20       4.0606      0.00000

 k-point 412 :       0.0417   -0.2917    0.4583
  band No.  band energies     occupation 
      1      -1.1194      0.00000
      2       2.3614      0.00000
      3       3.7805      0.00000
      4      -5.9065      0.00000
      5      -5.2246      0.00000
      6       4.8113      0.00000
      7       7.7659      0.00000
      8      -1.0921      0.00000
      9      -9.0322      0.00000
     10       5.2627      0.00000
     11      -5.5191      0.00000
     12       1.7847      0.00000
     13       1.6730      0.00000
     14       4.4731      0.00000
     15       4.7460      0.00000
     16      -5.6469      0.00000
     17       0.0006      0.00000
     18       8.7257      0.00000
     19      -5.6348      0.00000
     20      -1.7752      0.00000

 k-point 413 :       0.4583    0.0417   -0.2917
  band No.  band energies     occupation 
      1       1.1490      0.00000
      2      -4.6127      0.00000
      3       4.4830      0.00000
      4      -0.9582      0.00000
      5      -0.7032      0.00000
      6       1.7633      0.00000
      7       3.5821      0.00000
      8      -2.7693      0.00000
      9       0.8098      0.00000
     10      -0.7724      0.00000
     11      -3.9938      0.00000
     12       0.1469      0.00000
     13      -3.6469      0.00000
     14       3.7060      0.00000
     15      -3.9125      0.00000
     16       1.8400      0.00000
     17       3.5637      0.00000
     18       5.2681      0.00000
     19      -8.1914      0.00000
     20      -0.8918      0.00000

 k-point 414 :       0.4167   -0.3333   -0.0417
  band No.  band energies     occupation 
      1       1.2514      0.00000
      2      -4.7045      0.00000
      3       3.5250      0.00000
      4       0.2032      0.00000
      5      -0.5296      0.00000
      6       1.5679      0.00000
      7       0.6451      0.00000
      8       2.5320      0.00000
      9      -3.9088      0.00000
     10       2.0818      0.00000
     11      -4.4888      0.00000
     12       1.6141      0.00000
     13      -5.6130      0.00000
     14       1.6780      0.00000
     15      -4.8339      0.00000
     16       6.8319      0.00000
     17       1.8330      0.00000
     18       5.4531      0.00000
     19     -10.1924      0.00000
     20       1.0242      0.00000

 k-point 415 :      -0.7500   -0.4167   -0.4583
  band No.  band energies     occupation 
      1       1.1194      0.00000
      2      -2.3614      0.00000
      3      -3.7805      0.00000
      4       5.9065      0.00000
      5       5.2246      0.00000
      6      -4.8113      0.00000
      7      -7.7659      0.00000
      8       1.0921      0.00000
      9       9.0322      0.00000
     10      -5.2627      0.00000
     11       5.5191      0.00000
     12      -1.7847      0.00000
     13      -1.6730      0.00000
     14      -4.4731      0.00000
     15      -4.7460      0.00000
     16       5.6469      0.00000
     17      -0.0006      0.00000
     18      -8.7257      0.00000
     19       5.6348      0.00000
     20       1.7752      0.00000

 k-point 416 :       0.3333    0.7500    0.2917
  band No.  band energies     occupation 
      1      -1.1490      0.00000
      2       4.6127      0.00000
      3      -4.4830      0.00000
      4       0.9582      0.00000
      5       0.7032      0.00000
      6      -1.7633      0.00000
      7      -3.5821      0.00000
      8       2.7693      0.00000
      9      -0.8098      0.00000
     10       0.7724      0.00000
     11       3.9938      0.00000
     12      -0.1469      0.00000
     13       3.6469      0.00000
     14      -3.7060      0.00000
     15       3.9125      0.00000
     16      -1.8400      0.00000
     17      -3.5637      0.00000
     18      -5.2681      0.00000
     19       8.1914      0.00000
     20       0.8918      0.00000

 k-point 417 :       0.0417   -0.2083    0.4583
  band No.  band energies     occupation 
      1      -1.6433      0.00000
      2       3.8382      0.00000
      3       3.4725      0.00000
      4      -6.8194      0.00000
      5      -6.2881      0.00000
      6       8.8465      0.00000
      7      -4.2177      0.00000
      8       3.8990      0.00000
      9      -2.0743      0.00000
     10      -0.7878      0.00000
     11      -2.9041      0.00000
     12       4.0219      0.00000
     13       0.4836      0.00000
     14       2.4090      0.00000
     15       9.6359      0.00000
     16       5.0175      0.00000
     17       6.8897      0.00000
     18     -11.7591      0.00000
     19     -12.9782      0.00000
     20       1.8512      0.00000

 k-point 418 :       0.4583    0.0417   -0.2083
  band No.  band energies     occupation 
      1       1.6647      0.00000
      2      -4.4013      0.00000
      3       4.8381      0.00000
      4      -2.1063      0.00000
      5      -1.6174      0.00000
      6       8.1705      0.00000
      7      -6.4314      0.00000
      8       7.3451      0.00000
      9      -4.3691      0.00000
     10      -0.4324      0.00000
     11      -5.4831      0.00000
     12       0.8217      0.00000
     13      -3.0439      0.00000
     14      -1.9457      0.00000
     15      -0.1846      0.00000
     16      -3.4377      0.00000
     17       7.6474      0.00000
     18       7.2029      0.00000
     19      -7.1689      0.00000
     20       5.7140      0.00000

 k-point 419 :       0.4167   -0.2500   -0.0417
  band No.  band energies     occupation 
      1       1.6865      0.00000
      2      -4.3428      0.00000
      3       2.7241      0.00000
      4       0.2933      0.00000
      5      -0.2709      0.00000
      6       2.9819      0.00000
      7      -2.5058      0.00000
      8       7.7842      0.00000
      9      -7.5767      0.00000
     10       3.4700      0.00000
     11      -6.4644      0.00000
     12       2.6785      0.00000
     13      -6.2116      0.00000
     14      -2.1045      0.00000
     15      -1.7631      0.00000
     16       3.4422      0.00000
     17       0.6739      0.00000
     18      10.2656      0.00000
     19     -10.7285      0.00000
     20       7.5638      0.00000

 k-point 420 :      -0.6667   -0.4167   -0.4583
  band No.  band energies     occupation 
      1       1.6433      0.00000
      2      -3.8382      0.00000
      3      -3.4725      0.00000
      4       6.8194      0.00000
      5       6.2881      0.00000
      6      -8.8465      0.00000
      7       4.2177      0.00000
      8      -3.8990      0.00000
      9       2.0743      0.00000
     10       0.7878      0.00000
     11       2.9041      0.00000
     12      -4.0219      0.00000
     13      -0.4836      0.00000
     14      -2.4090      0.00000
     15      -9.6359      0.00000
     16      -5.0175      0.00000
     17      -6.8897      0.00000
     18      11.7591      0.00000
     19      12.9782      0.00000
     20      -1.8512      0.00000

 k-point 421 :       0.2500    0.6667    0.2083
  band No.  band energies     occupation 
      1      -1.6647      0.00000
      2       4.4013      0.00000
      3      -4.8381      0.00000
      4       2.1063      0.00000
      5       1.6174      0.00000
      6      -8.1705      0.00000
      7       6.4314      0.00000
      8      -7.3451      0.00000
      9       4.3691      0.00000
     10       0.4324      0.00000
     11       5.4831      0.00000
     12      -0.8217      0.00000
     13       3.0439      0.00000
     14       1.9457      0.00000
     15       0.1846      0.00000
     16       3.4377      0.00000
     17      -7.6474      0.00000
     18      -7.2029      0.00000
     19       7.1689      0.00000
     20      -5.7140      0.00000

 k-point 422 :       0.0417   -0.1250    0.4583
  band No.  band energies     occupation 
      1      -1.5641      0.00000
      2       3.8557      0.00000
      3       4.4392      0.00000
      4      -7.9325      0.00000
      5      -8.4053      0.00000
      6       9.5223      0.00000
      7      -3.2544      0.00000
      8      -4.1476      0.00000
      9       7.2961      0.00000
     10      -4.6246      0.00000
     11      -2.1583      0.00000
     12       9.0876      0.00000
     13       0.9342      0.00000
     14       2.5962      0.00000
     15       7.7866      0.00000
     16      -3.8776      0.00000
     17      11.6858      0.00000
     18      -4.6449      0.00000
     19     -17.0327      0.00000
     20      -3.9152      0.00000

 k-point 423 :       0.4583    0.0417   -0.1250
  band No.  band energies     occupation 
      1       1.5457      0.00000
      2      -3.8968      0.00000
      3       6.0638      0.00000
      4      -3.8051      0.00000
      5      -4.7149      0.00000
      6      11.8329      0.00000
      7      -2.5393      0.00000
      8       7.8959      0.00000
      9     -10.5716      0.00000
     10       0.3886      0.00000
     11      -5.2259      0.00000
     12       0.6474      0.00000
     13      -1.6499      0.00000
     14      -4.1366      0.00000
     15      -1.1925      0.00000
     16      -4.0866      0.00000
     17       5.5599      0.00000
     18      -6.3908      0.00000
     19      13.4869      0.00000
     20       8.6969      0.00000

 k-point 424 :       0.4167   -0.1667   -0.0417
  band No.  band energies     occupation 
      1       1.5303      0.00000
      2      -3.8172      0.00000
      3       2.0907      0.00000
      4       0.5355      0.00000
      5       1.4447      0.00000
      6       1.5362      0.00000
      7       1.0047      0.00000
      8       5.8897      0.00000
      9      -9.3853      0.00000
     10       3.3732      0.00000
     11      -6.3184      0.00000
     12       1.7451      0.00000
     13      -5.2248      0.00000
     14      -1.7201      0.00000
     15      -4.4067      0.00000
     16      -2.3766      0.00000
     17       3.2274      0.00000
     18       4.3940      0.00000
     19       0.4790      0.00000
     20      13.1063      0.00000

 k-point 425 :      -0.5833   -0.4167   -0.4583
  band No.  band energies     occupation 
      1       1.5641      0.00000
      2      -3.8557      0.00000
      3      -4.4392      0.00000
      4       7.9325      0.00000
      5       8.4053      0.00000
      6      -9.5223      0.00000
      7       3.2544      0.00000
      8       4.1476      0.00000
      9      -7.2961      0.00000
     10       4.6246      0.00000
     11       2.1583      0.00000
     12      -9.0876      0.00000
     13      -0.9342      0.00000
     14      -2.5962      0.00000
     15      -7.7866      0.00000
     16       3.8776      0.00000
     17     -11.6858      0.00000
     18       4.6449      0.00000
     19      17.0327      0.00000
     20       3.9152      0.00000

 k-point 426 :       0.1667    0.5833    0.1250
  band No.  band energies     occupation 
      1      -1.5457      0.00000
      2       3.8968      0.00000
      3      -6.0638      0.00000
      4       3.8051      0.00000
      5       4.7149      0.00000
      6     -11.8329      0.00000
      7       2.5393      0.00000
      8      -7.8959      0.00000
      9      10.5716      0.00000
     10      -0.3886      0.00000
     11       5.2259      0.00000
     12      -0.6474      0.00000
     13       1.6499      0.00000
     14       4.1366      0.00000
     15       1.1925      0.00000
     16       4.0866      0.00000
     17      -5.5599      0.00000
     18       6.3908      0.00000
     19     -13.4869      0.00000
     20      -8.6969      0.00000

 k-point 427 :       0.0417   -0.0417    0.4583
  band No.  band energies     occupation 
      1      -0.8578      0.00000
      2       3.1311      0.00000
      3       5.6330      0.00000
      4      -8.7011      0.00000
      5      -2.9619      0.00000
      6       1.2623      0.00000
      7      -2.4052      0.00000
      8      -5.8588      0.00000
      9      10.1615      0.00000
     10      -4.9500      0.00000
     11      -3.5349      0.00000
     12      13.8686      0.00000
     13       1.6846      0.00000
     14      -0.0457      0.00000
     15       7.1719      0.00000
     16      -6.4123      0.00000
     17      10.8129      0.00000
     18      -1.9951      0.00000
     19      -6.0391      0.00000
     20      -1.4007      0.00000

 k-point 428 :       0.4583    0.0417   -0.0417
  band No.  band energies     occupation 
      1       0.8505      0.00000
      2      -3.0983      0.00000
      3       7.6399      0.00000
      4      -5.2592      0.00000
      5      -9.7778      0.00000
      6      17.2374      0.00000
      7      -2.4519      0.00000
      8       6.3589      0.00000
      9     -10.9976      0.00000
     10       3.2100      0.00000
     11      -4.2872      0.00000
     12      -2.9037      0.00000
     13      -2.0530      0.00000
     14      -1.6811      0.00000
     15      -4.7367      0.00000
     16      -1.0979      0.00000
     17      -0.2699      0.00000
     18       3.2931      0.00000
     19      -4.5529      0.00000
     20      12.4944      0.00000

 k-point 429 :       0.4167   -0.0833   -0.0417
  band No.  band energies     occupation 
      1       0.8377      0.00000
      2      -3.0273      0.00000
      3       1.7431      0.00000
      4       0.7054      0.00000
      5      12.5738      0.00000
      6     -10.2621      0.00000
      7       2.0572      0.00000
      8       4.9507      0.00000
      9      -9.0138      0.00000
     10       5.7615      0.00000
     11      -8.8260      0.00000
     12       0.4586      0.00000
     13      -0.4433      0.00000
     14      -4.5465      0.00000
     15      -6.1039      0.00000
     16      -7.1876      0.00000
     17       9.1153      0.00000
     18       4.5863      0.00000
     19       1.4191      0.00000
     20      10.9645      0.00000

 k-point 430 :      -0.5000   -0.4167   -0.4583
  band No.  band energies     occupation 
      1       0.8578      0.00000
      2      -3.1311      0.00000
      3      -5.6330      0.00000
      4       8.7011      0.00000
      5       2.9619      0.00000
      6      -1.2623      0.00000
      7       2.4052      0.00000
      8       5.8588      0.00000
      9     -10.1615      0.00000
     10       4.9500      0.00000
     11       3.5349      0.00000
     12     -13.8686      0.00000
     13      -1.6846      0.00000
     14       0.0457      0.00000
     15      -7.1719      0.00000
     16       6.4123      0.00000
     17     -10.8129      0.00000
     18       1.9951      0.00000
     19       6.0391      0.00000
     20       1.4007      0.00000

 k-point 431 :       0.0833    0.5000    0.0417
  band No.  band energies     occupation 
      1      -0.8505      0.00000
      2       3.0983      0.00000
      3      -7.6399      0.00000
      4       5.2592      0.00000
      5       9.7778      0.00000
      6     -17.2374      0.00000
      7       2.4519      0.00000
      8      -6.3589      0.00000
      9      10.9976      0.00000
     10      -3.2100      0.00000
     11       4.2872      0.00000
     12       2.9037      0.00000
     13       2.0530      0.00000
     14       1.6811      0.00000
     15       4.7367      0.00000
     16       1.0979      0.00000
     17       0.2699      0.00000
     18      -3.2931      0.00000
     19       4.5529      0.00000
     20     -12.4944      0.00000

 k-point 432 :       0.0417   -0.4583   -0.4583
  band No.  band energies     occupation 
      1       0.0381      0.00000
      2      -0.0246      0.00000
      3      -4.9600      0.00000
      4       4.9966      0.00000
      5       2.0983      0.00000
      6      -2.1244      0.00000
      7     -10.1213      0.00000
      8       9.7017      0.00000
      9      15.5206      0.00000
     10     -15.6844      0.00000
     11      11.5964      0.00000
     12     -11.3028      0.00000
     13      -1.7179      0.00000
     14       2.5210      0.00000
     15       2.7219      0.00000
     16     -10.1680      0.00000
     17       8.6626      0.00000
     18      -1.8579      0.00000
     19      -5.9839      0.00000
     20       5.6338      0.00000

 k-point 433 :      -0.5000   -0.5000   -0.0417
  band No.  band energies     occupation 
      1       0.1270      0.00000
      2      -0.2386      0.00000
      3       0.1641      0.00000
      4      -0.0194      0.00000
      5      -0.4897      0.00000
      6       0.4872      0.00000
      7       0.2531      0.00000
      8      -0.1157      0.00000
      9       1.4915      0.00000
     10      -1.5016      0.00000
     11      -0.5867      0.00000
     12       0.0138      0.00000
     13      -1.5970      0.00000
     14       1.8441      0.00000
     15       7.3070      0.00000
     16       1.1676      0.00000
     17     -10.6012      0.00000
     18      -5.4279      0.00000
     19      -1.0727      0.00000
     20       8.1061      0.00000

 k-point 434 :       0.0000    0.5000    0.4583
  band No.  band energies     occupation 
      1      -0.0381      0.00000
      2       0.0246      0.00000
      3       4.9600      0.00000
      4      -4.9966      0.00000
      5      -2.0983      0.00000
      6       2.1244      0.00000
      7      10.1213      0.00000
      8      -9.7017      0.00000
      9     -15.5206      0.00000
     10      15.6844      0.00000
     11     -11.5964      0.00000
     12      11.3028      0.00000
     13       1.7179      0.00000
     14      -2.5210      0.00000
     15      -2.7219      0.00000
     16      10.1680      0.00000
     17      -8.6626      0.00000
     18       1.8579      0.00000
     19       5.9839      0.00000
     20      -5.6338      0.00000

 k-point 435 :       0.0417   -0.3750   -0.4583
  band No.  band energies     occupation 
      1      -0.0385      0.00000
      2      -0.0237      0.00000
      3       5.0057      0.00000
      4      -5.0632      0.00000
      5      -2.1206      0.00000
      6       2.1643      0.00000
      7       2.6865      0.00000
      8      -1.6705      0.00000
      9     -15.7563      0.00000
     10      15.7658      0.00000
     11      -8.4307      0.00000
     12       7.6673      0.00000
     13       0.8574      0.00000
     14      -2.2278      0.00000
     15      -0.4278      0.00000
     16       5.1864      0.00000
     17      -5.4475      0.00000
     18       2.3999      0.00000
     19      -2.0458      0.00000
     20       3.0913      0.00000

 k-point 436 :      -0.4583    0.0417   -0.3750
  band No.  band energies     occupation 
      1       0.0787      0.00000
      2      -0.5651      0.00000
      3       1.2318      0.00000
      4      -0.6753      0.00000
      5      -0.4735      0.00000
      6       0.5024      0.00000
      7       0.9737      0.00000
      8      -0.6603      0.00000
      9       2.4321      0.00000
     10      -2.3722      0.00000
     11      -2.4218      0.00000
     12       0.9529      0.00000
     13      -1.5556      0.00000
     14       4.9536      0.00000
     15      -0.2196      0.00000
     16       1.5433      0.00000
     17      -4.1741      0.00000
     18      -0.4397      0.00000
     19      -0.1216      0.00000
     20      -1.2115      0.00000

 k-point 437 :      -0.5000   -0.4167   -0.0417
  band No.  band energies     occupation 
      1       0.2088      0.00000
      2      -1.4104      0.00000
      3       0.9582      0.00000
      4       0.5191      0.00000
      5      -1.4637      0.00000
      6       1.5021      0.00000
      7      -0.4623      0.00000
      8       1.7607      0.00000
      9       1.9903      0.00000
     10      -2.4287      0.00000
     11      -4.6944      0.00000
     12       0.5383      0.00000
     13      -3.2382      0.00000
     14       3.8780      0.00000
     15       8.5731      0.00000
     16       2.1652      0.00000
     17      -8.6019      0.00000
     18      -1.6273      0.00000
     19      -4.7981      0.00000
     20       1.9730      0.00000

 k-point 438 :       0.0833    0.5000    0.4583
  band No.  band energies     occupation 
      1       0.0385      0.00000
      2       0.0237      0.00000
      3      -5.0057      0.00000
      4       5.0632      0.00000
      5       2.1206      0.00000
      6      -2.1643      0.00000
      7      -2.6865      0.00000
      8       1.6705      0.00000
      9      15.7563      0.00000
     10     -15.7658      0.00000
     11       8.4307      0.00000
     12      -7.6673      0.00000
     13      -0.8574      0.00000
     14       2.2278      0.00000
     15       0.4278      0.00000
     16      -5.1864      0.00000
     17       5.4475      0.00000
     18      -2.3999      0.00000
     19       2.0458      0.00000
     20      -3.0913      0.00000

 k-point 439 :       0.4167   -0.0833    0.3750
  band No.  band energies     occupation 
      1      -0.0787      0.00000
      2       0.5651      0.00000
      3      -1.2318      0.00000
      4       0.6753      0.00000
      5       0.4735      0.00000
      6      -0.5024      0.00000
      7      -0.9737      0.00000
      8       0.6603      0.00000
      9      -2.4321      0.00000
     10       2.3722      0.00000
     11       2.4218      0.00000
     12      -0.9529      0.00000
     13       1.5556      0.00000
     14      -4.9536      0.00000
     15       0.2196      0.00000
     16      -1.5433      0.00000
     17       4.1741      0.00000
     18       0.4397      0.00000
     19       0.1216      0.00000
     20       1.2115      0.00000

 k-point 440 :       0.0417   -0.2917   -0.4583
  band No.  band energies     occupation 
      1      -0.1196      0.00000
      2       0.4075      0.00000
      3       4.8341      0.00000
      4      -5.5082      0.00000
      5      -4.2673      0.00000
      6       4.1957      0.00000
      7       4.2290      0.00000
      8      -1.0622      0.00000
      9     -12.6093      0.00000
     10      11.3482      0.00000
     11      -6.1219      0.00000
     12       2.3585      0.00000
     13       0.9639      0.00000
     14       4.6616      0.00000
     15       3.5450      0.00000
     16       0.1337      0.00000
     17      -0.4251      0.00000
     18      -6.4209      0.00000
     19      -1.0955      0.00000
     20       2.2955      0.00000

 k-point 441 :      -0.4583    0.0417   -0.2917
  band No.  band energies     occupation 
      1       0.1789      0.00000
      2      -3.8721      0.00000
      3       5.4966      0.00000
      4      -1.6151      0.00000
      5      -0.9635      0.00000
      6       1.4129      0.00000
      7       2.7626      0.00000
      8      -1.3163      0.00000
      9       1.5250      0.00000
     10      -1.6747      0.00000
     11      -6.0790      0.00000
     12       1.3127      0.00000
     13      -3.5945      0.00000
     14       3.2413      0.00000
     15       5.3534      0.00000
     16      -1.7036      0.00000
     17       4.5984      0.00000
     18      -5.2149      0.00000
     19      -1.5809      0.00000
     20      -2.5713      0.00000

 k-point 442 :      -0.5000   -0.3333   -0.0417
  band No.  band energies     occupation 
      1       0.2412      0.00000
      2      -4.5403      0.00000
      3       3.9147      0.00000
      4       0.9539      0.00000
      5      -1.4982      0.00000
      6       2.0758      0.00000
      7       0.4711      0.00000
      8       2.3045      0.00000
      9      -2.3716      0.00000
     10       1.0896      0.00000
     11      -7.4890      0.00000
     12       1.5562      0.00000
     13      -3.2701      0.00000
     14       2.1592      0.00000
     15       2.6367      0.00000
     16       2.0127      0.00000
     17       6.7360      0.00000
     18      -5.5236      0.00000
     19      -5.3788      0.00000
     20      -1.6777      0.00000

 k-point 443 :       0.1667    0.5000    0.4583
  band No.  band energies     occupation 
      1       0.1196      0.00000
      2      -0.4075      0.00000
      3      -4.8341      0.00000
      4       5.5082      0.00000
      5       4.2673      0.00000
      6      -4.1957      0.00000
      7      -4.2290      0.00000
      8       1.0622      0.00000
      9      12.6093      0.00000
     10     -11.3482      0.00000
     11       6.1219      0.00000
     12      -2.3585      0.00000
     13      -0.9639      0.00000
     14      -4.6616      0.00000
     15      -3.5450      0.00000
     16      -0.1337      0.00000
     17       0.4251      0.00000
     18       6.4209      0.00000
     19       1.0955      0.00000
     20      -2.2955      0.00000

 k-point 444 :       0.3333   -0.1667    0.2917
  band No.  band energies     occupation 
      1      -0.1789      0.00000
      2       3.8721      0.00000
      3      -5.4966      0.00000
      4       1.6151      0.00000
      5       0.9635      0.00000
      6      -1.4129      0.00000
      7      -2.7626      0.00000
      8       1.3163      0.00000
      9      -1.5250      0.00000
     10       1.6747      0.00000
     11       6.0790      0.00000
     12      -1.3127      0.00000
     13       3.5945      0.00000
     14      -3.2413      0.00000
     15      -5.3534      0.00000
     16       1.7036      0.00000
     17      -4.5984      0.00000
     18       5.2149      0.00000
     19       1.5809      0.00000
     20       2.5713      0.00000

 k-point 445 :       0.0417   -0.2083   -0.4583
  band No.  band energies     occupation 
      1      -0.2310      0.00000
      2       2.0779      0.00000
      3       3.6463      0.00000
      4      -6.0200      0.00000
      5      -5.7938      0.00000
      6       7.0041      0.00000
      7       1.9645      0.00000
      8      -0.4812      0.00000
      9      -7.1389      0.00000
     10       4.9593      0.00000
     11      -3.7177      0.00000
     12       1.4109      0.00000
     13       0.6599      0.00000
     14       6.9475      0.00000
     15       5.0597      0.00000
     16       6.8061      0.00000
     17     -10.3707      0.00000
     18      -8.6481      0.00000
     19      -1.8391      0.00000
     20      12.2812      0.00000

 k-point 446 :      -0.4583    0.0417   -0.2083
  band No.  band energies     occupation 
      1       0.2820      0.00000
      2      -3.4925      0.00000
      3       6.7304      0.00000
      4      -3.3161      0.00000
      5      -1.5296      0.00000
      6       7.3888      0.00000
      7      -0.3095      0.00000
      8      -0.4844      0.00000
      9      -2.0842      0.00000
     10      -0.2734      0.00000
     11      -8.5810      0.00000
     12       2.3797      0.00000
     13      -3.0974      0.00000
     14       1.1355      0.00000
     15       0.4501      0.00000
     16       2.7186      0.00000
     17      -4.5178      0.00000
     18       5.0793      0.00000
     19      -0.7730      0.00000
     20       8.5464      0.00000

 k-point 447 :      -0.5000   -0.2500   -0.0417
  band No.  band energies     occupation 
      1       0.3093      0.00000
      2      -3.6147      0.00000
      3       2.0603      0.00000
      4       2.0332      0.00000
      5      -1.3665      0.00000
      6       7.2470      0.00000
      7      -3.3399      0.00000
      8       3.0133      0.00000
      9      -5.2620      0.00000
     10       2.7595      0.00000
     11      -8.5484      0.00000
     12       1.8025      0.00000
     13      -3.0726      0.00000
     14      -2.6153      0.00000
     15       0.1718      0.00000
     16       5.3622      0.00000
     17      -8.2783      0.00000
     18      11.3740      0.00000
     19      -3.5231      0.00000
     20      12.2862      0.00000

 k-point 448 :       0.2500    0.5000    0.4583
  band No.  band energies     occupation 
      1       0.2310      0.00000
      2      -2.0779      0.00000
      3      -3.6463      0.00000
      4       6.0200      0.00000
      5       5.7938      0.00000
      6      -7.0041      0.00000
      7      -1.9645      0.00000
      8       0.4812      0.00000
      9       7.1389      0.00000
     10      -4.9593      0.00000
     11       3.7177      0.00000
     12      -1.4109      0.00000
     13      -0.6599      0.00000
     14      -6.9475      0.00000
     15      -5.0597      0.00000
     16      -6.8061      0.00000
     17      10.3707      0.00000
     18       8.6481      0.00000
     19       1.8391      0.00000
     20     -12.2812      0.00000

 k-point 449 :       0.2500   -0.2500    0.2083
  band No.  band energies     occupation 
      1      -0.2820      0.00000
      2       3.4925      0.00000
      3      -6.7304      0.00000
      4       3.3161      0.00000
      5       1.5296      0.00000
      6      -7.3888      0.00000
      7       0.3095      0.00000
      8       0.4844      0.00000
      9       2.0842      0.00000
     10       0.2734      0.00000
     11       8.5810      0.00000
     12      -2.3797      0.00000
     13       3.0974      0.00000
     14      -1.1355      0.00000
     15      -0.4501      0.00000
     16      -2.7186      0.00000
     17       4.5178      0.00000
     18      -5.0793      0.00000
     19       0.7730      0.00000
     20      -8.5464      0.00000

 k-point 450 :       0.0417   -0.1250   -0.4583
  band No.  band energies     occupation 
      1      -0.4325      0.00000
      2       2.5802      0.00000
      3       2.7045      0.00000
      4      -5.3141      0.00000
      5      -8.1922      0.00000
      6       7.8062      0.00000
      7      -2.2386      0.00000
      8       0.4196      0.00000
      9       0.5040      0.00000
     10       0.1431      0.00000
     11       1.0077      0.00000
     12       0.4582      0.00000
     13       0.5565      0.00000
     14       6.3242      0.00000
     15       7.0729      0.00000
     16       7.0396      0.00000
     17     -12.2405      0.00000
     18      -4.7916      0.00000
     19     -14.2081      0.00000
     20       3.4228      0.00000

 k-point 451 :      -0.4583    0.0417   -0.1250
  band No.  band energies     occupation 
      1       0.4673      0.00000
      2      -2.9849      0.00000
      3       8.3019      0.00000
      4      -5.6661      0.00000
      5      -3.1534      0.00000
      6       9.7033      0.00000
      7      -1.9718      0.00000
      8       5.2280      0.00000
      9      -8.0485      0.00000
     10       0.5814      0.00000
     11      -6.4600      0.00000
     12       0.5754      0.00000
     13      -2.3536      0.00000
     14      -1.5333      0.00000
     15      -1.4029      0.00000
     16       1.6289      0.00000
     17      -4.0582      0.00000
     18       1.4803      0.00000
     19       5.6898      0.00000
     20       8.7604      0.00000

 k-point 452 :      -0.5000   -0.1667   -0.0417
  band No.  band energies     occupation 
      1       0.4790      0.00000
      2      -3.0358      0.00000
      3      -1.4279      0.00000
      4       4.8919      0.00000
      5      -0.9363      0.00000
      6       3.1510      0.00000
      7       1.7180      0.00000
      8       4.5079      0.00000
      9      -8.5079      0.00000
     10       3.6695      0.00000
     11      -2.4803      0.00000
     12      -5.8782      0.00000
     13      -2.1653      0.00000
     14       0.1506      0.00000
     15      -5.6373      0.00000
     16       5.3282      0.00000
     17      -9.4257      0.00000
     18      -1.0223      0.00000
     19      11.5797      0.00000
     20      11.1625      0.00000

 k-point 453 :       0.3333    0.5000    0.4583
  band No.  band energies     occupation 
      1       0.4325      0.00000
      2      -2.5802      0.00000
      3      -2.7045      0.00000
      4       5.3141      0.00000
      5       8.1922      0.00000
      6      -7.8062      0.00000
      7       2.2386      0.00000
      8      -0.4196      0.00000
      9      -0.5040      0.00000
     10      -0.1431      0.00000
     11      -1.0077      0.00000
     12      -0.4582      0.00000
     13      -0.5565      0.00000
     14      -6.3242      0.00000
     15      -7.0729      0.00000
     16      -7.0396      0.00000
     17      12.2405      0.00000
     18       4.7916      0.00000
     19      14.2081      0.00000
     20      -3.4228      0.00000

 k-point 454 :       0.1667   -0.3333    0.1250
  band No.  band energies     occupation 
      1      -0.4673      0.00000
      2       2.9849      0.00000
      3      -8.3019      0.00000
      4       5.6661      0.00000
      5       3.1534      0.00000
      6      -9.7033      0.00000
      7       1.9718      0.00000
      8      -5.2280      0.00000
      9       8.0485      0.00000
     10      -0.5814      0.00000
     11       6.4600      0.00000
     12      -0.5754      0.00000
     13       2.3536      0.00000
     14       1.5333      0.00000
     15       1.4029      0.00000
     16      -1.6289      0.00000
     17       4.0582      0.00000
     18      -1.4803      0.00000
     19      -5.6898      0.00000
     20      -8.7604      0.00000

 k-point 455 :       0.0417   -0.3750   -0.3750
  band No.  band energies     occupation 
      1       0.0049      0.00000
      2       0.0291      0.00000
      3      -5.2013      0.00000
      4       5.2034      0.00000
      5       0.4923      0.00000
      6      -0.5026      0.00000
      7      -8.7502      0.00000
      8       8.4537      0.00000
      9       3.0084      0.00000
     10      -2.9723      0.00000
     11       7.0494      0.00000
     12      -9.8519      0.00000
     13       3.1827      0.00000
     14       2.4680      0.00000
     15      -7.9303      0.00000
     16       6.1956      0.00000
     17      -0.5057      0.00000
     18      -0.4094      0.00000
     19       2.3131      0.00000
     20      -5.1326      0.00000

 k-point 456 :      -0.4167   -0.4167   -0.0417
  band No.  band energies     occupation 
      1       0.0292      0.00000
      2      -0.8494      0.00000
      3       1.0982      0.00000
      4      -0.0988      0.00000
      5      -0.5668      0.00000
      6       0.5483      0.00000
      7       1.0435      0.00000
      8      -0.4550      0.00000
      9       1.7778      0.00000
     10      -1.9351      0.00000
     11      -5.2438      0.00000
     12       0.2590      0.00000
     13       2.2444      0.00000
     14       4.8555      0.00000
     15       0.4877      0.00000
     16      -5.6172      0.00000
     17       2.5516      0.00000
     18       0.5793      0.00000
     19      -4.1567      0.00000
     20      -1.0592      0.00000

 k-point 457 :       0.0000    0.4167    0.3750
  band No.  band energies     occupation 
      1      -0.0049      0.00000
      2      -0.0291      0.00000
      3       5.2013      0.00000
      4      -5.2034      0.00000
      5      -0.4923      0.00000
      6       0.5026      0.00000
      7       8.7502      0.00000
      8      -8.4537      0.00000
      9      -3.0084      0.00000
     10       2.9723      0.00000
     11      -7.0494      0.00000
     12       9.8519      0.00000
     13      -3.1827      0.00000
     14      -2.4680      0.00000
     15       7.9303      0.00000
     16      -6.1956      0.00000
     17       0.5057      0.00000
     18       0.4094      0.00000
     19      -2.3131      0.00000
     20       5.1326      0.00000

 k-point 458 :       0.0417   -0.2917   -0.3750
  band No.  band energies     occupation 
      1      -0.0070      0.00000
      2       0.0230      0.00000
      3       4.1277      0.00000
      4      -4.2053      0.00000
      5      -1.0773      0.00000
      6       1.0469      0.00000
      7       0.8293      0.00000
      8      -0.2175      0.00000
      9      -6.1211      0.00000
     10       5.8171      0.00000
     11      -1.7937      0.00000
     12       2.1207      0.00000
     13      -2.9784      0.00000
     14       2.7436      0.00000
     15       4.4218      0.00000
     16      -4.6928      0.00000
     17       1.0724      0.00000
     18      -0.9747      0.00000
     19      -1.3159      0.00000
     20       1.0154      0.00000

 k-point 459 :      -0.3750    0.0417   -0.2917
  band No.  band energies     occupation 
      1       0.0132      0.00000
      2      -2.0945      0.00000
      3       4.3380      0.00000
      4      -2.0651      0.00000
      5      -0.5089      0.00000
      6       0.5618      0.00000
      7       0.7557      0.00000
      8      -0.0448      0.00000
      9       1.8043      0.00000
     10      -2.0587      0.00000
     11      -3.7384      0.00000
     12       0.7547      0.00000
     13       0.6212      0.00000
     14       0.6461      0.00000
     15       1.2971      0.00000
     16      -1.9804      0.00000
     17       0.4259      0.00000
     18       1.8288      0.00000
     19       0.7855      0.00000
     20      -4.0921      0.00000

 k-point 460 :      -0.4167   -0.3333   -0.0417
  band No.  band energies     occupation 
      1       0.0326      0.00000
      2      -4.5534      0.00000
      3       1.9768      0.00000
      4       3.2967      0.00000
      5      -1.7044      0.00000
      6       1.7577      0.00000
      7       0.1862      0.00000
      8       1.7796      0.00000
      9       3.3995      0.00000
     10      -4.2821      0.00000
     11      -9.8898      0.00000
     12       0.3699      0.00000
     13       5.9774      0.00000
     14      -0.5986      0.00000
     15       1.4364      0.00000
     16      -5.2675      0.00000
     17       2.3130      0.00000
     18       6.1113      0.00000
     19      -0.3447      0.00000
     20     -11.8828      0.00000

 k-point 461 :       0.0833    0.4167    0.3750
  band No.  band energies     occupation 
      1       0.0070      0.00000
      2      -0.0230      0.00000
      3      -4.1277      0.00000
      4       4.2053      0.00000
      5       1.0773      0.00000
      6      -1.0469      0.00000
      7      -0.8293      0.00000
      8       0.2175      0.00000
      9       6.1211      0.00000
     10      -5.8171      0.00000
     11       1.7937      0.00000
     12      -2.1207      0.00000
     13       2.9784      0.00000
     14      -2.7436      0.00000
     15      -4.4218      0.00000
     16       4.6928      0.00000
     17      -1.0724      0.00000
     18       0.9747      0.00000
     19       1.3159      0.00000
     20      -1.0154      0.00000

 k-point 462 :       0.3333   -0.0833    0.2917
  band No.  band energies     occupation 
      1      -0.0132      0.00000
      2       2.0945      0.00000
      3      -4.3380      0.00000
      4       2.0651      0.00000
      5       0.5089      0.00000
      6      -0.5618      0.00000
      7      -0.7557      0.00000
      8       0.0448      0.00000
      9      -1.8043      0.00000
     10       2.0587      0.00000
     11       3.7384      0.00000
     12      -0.7547      0.00000
     13      -0.6212      0.00000
     14      -0.6461      0.00000
     15      -1.2971      0.00000
     16       1.9804      0.00000
     17      -0.4259      0.00000
     18      -1.8288      0.00000
     19      -0.7855      0.00000
     20       4.0921      0.00000

 k-point 463 :       0.0417   -0.2083   -0.3750
  band No.  band energies     occupation 
      1      -0.0209      0.00000
      2       1.7171      0.00000
      3       1.2706      0.00000
      4      -3.0579      0.00000
      5      -3.7442      0.00000
      6       3.3760      0.00000
      7       1.9516      0.00000
      8      -0.3767      0.00000
      9     -14.1986      0.00000
     10      12.8743      0.00000
     11      -1.2399      0.00000
     12       0.0169      0.00000
     13      -3.5286      0.00000
     14       7.7108      0.00000
     15       6.2666      0.00000
     16      -8.5793      0.00000
     17       4.2131      0.00000
     18      -4.8237      0.00000
     19      -2.8410      0.00000
     20      12.1786      0.00000

 k-point 464 :      -0.3750    0.0417   -0.2083
  band No.  band energies     occupation 
      1       0.0222      0.00000
      2      -4.0537      0.00000
      3       8.2324      0.00000
      4      -3.7716      0.00000
      5      -1.2019      0.00000
      6       2.2291      0.00000
      7       2.0275      0.00000
      8       0.0095      0.00000
      9       0.8027      0.00000
     10      -2.7607      0.00000
     11      -5.7379      0.00000
     12       0.8892      0.00000
     13      -0.7768      0.00000
     14       0.3373      0.00000
     15       1.0031      0.00000
     16      -0.6483      0.00000
     17      -0.4524      0.00000
     18       4.4550      0.00000
     19       1.4169      0.00000
     20      -1.4887      0.00000

 k-point 465 :      -0.4167   -0.2500   -0.0417
  band No.  band energies     occupation 
      1       0.0227      0.00000
      2      -4.6183      0.00000
      3      -0.9258      0.00000
      4       6.7852      0.00000
      5      -2.3158      0.00000
      6       4.3907      0.00000
      7      -1.0565      0.00000
      8       2.5967      0.00000
      9      -0.9648      0.00000
     10      -1.0592      0.00000
     11      -8.4812      0.00000
     12       0.8326      0.00000
     13       1.2877      0.00000
     14      -3.5843      0.00000
     15       1.8584      0.00000
     16      -2.1005      0.00000
     17       1.0230      0.00000
     18       8.4212      0.00000
     19      -0.0150      0.00000
     20      -3.9270      0.00000

 k-point 466 :       0.1667    0.4167    0.3750
  band No.  band energies     occupation 
      1       0.0209      0.00000
      2      -1.7171      0.00000
      3      -1.2706      0.00000
      4       3.0579      0.00000
      5       3.7442      0.00000
      6      -3.3760      0.00000
      7      -1.9516      0.00000
      8       0.3767      0.00000
      9      14.1986      0.00000
     10     -12.8743      0.00000
     11       1.2399      0.00000
     12      -0.0169      0.00000
     13       3.5286      0.00000
     14      -7.7108      0.00000
     15      -6.2666      0.00000
     16       8.5793      0.00000
     17      -4.2131      0.00000
     18       4.8237      0.00000
     19       2.8410      0.00000
     20     -12.1786      0.00000

 k-point 467 :       0.2500   -0.1667    0.2083
  band No.  band energies     occupation 
      1      -0.0222      0.00000
      2       4.0537      0.00000
      3      -8.2324      0.00000
      4       3.7716      0.00000
      5       1.2019      0.00000
      6      -2.2291      0.00000
      7      -2.0275      0.00000
      8      -0.0094      0.00000
      9      -0.8027      0.00000
     10       2.7607      0.00000
     11       5.7379      0.00000
     12      -0.8892      0.00000
     13       0.7768      0.00000
     14      -0.3373      0.00000
     15      -1.0031      0.00000
     16       0.6483      0.00000
     17       0.4524      0.00000
     18      -4.4550      0.00000
     19      -1.4169      0.00000
     20       1.4887      0.00000

 k-point 468 :       0.0417   -0.1250   -0.3750
  band No.  band energies     occupation 
      1      -0.0396      0.00000
      2       2.2894      0.00000
      3      -2.7481      0.00000
      4       0.5365      0.00000
      5      -6.5804      0.00000
      6       5.0887      0.00000
      7      -1.2320      0.00000
      8       2.0745      0.00000
      9      -5.0146      0.00000
     10       5.3090      0.00000
     11      -0.5670      0.00000
     12       0.5818      0.00000
     13      -2.2450      0.00000
     14       6.5771      0.00000
     15       6.9726      0.00000
     16       6.5633      0.00000
     17      -9.8115      0.00000
     18      -3.3732      0.00000
     19     -11.1478      0.00000
     20       4.4053      0.00000

 k-point 469 :      -0.3750    0.0417   -0.1250
  band No.  band energies     occupation 
      1       0.0369      0.00000
      2      -3.0377      0.00000
      3       6.2571      0.00000
      4      -2.8409      0.00000
      5      -1.9346      0.00000
      6       6.5789      0.00000
      7      -1.2330      0.00000
      8       3.1924      0.00000
      9      -5.2228      0.00000
     10      -1.3696      0.00000
     11      -2.7527      0.00000
     12      -0.5429      0.00000
     13      -2.5871      0.00000
     14       0.9647      0.00000
     15       0.1963      0.00000
     16      -2.2683      0.00000
     17      -1.3860      0.00000
     18       4.1383      0.00000
     19       5.5896      0.00000
     20       3.3943      0.00000

 k-point 470 :      -0.4167   -0.1667   -0.0417
  band No.  band energies     occupation 
      1       0.0306      0.00000
      2      -3.2279      0.00000
      3      -4.5506      0.00000
      4       9.3236      0.00000
      5      -2.7321      0.00000
      6       3.9856      0.00000
      7       2.8060      0.00000
      8       1.6309      0.00000
      9      -5.5747      0.00000
     10       1.5420      0.00000
     11      -4.6840      0.00000
     12      -3.0245      0.00000
     13      -0.7446      0.00000
     14      -4.4929      0.00000
     15       2.4749      0.00000
     16       1.1200      0.00000
     17      -4.0360      0.00000
     18       3.3854      0.00000
     19       9.0771      0.00000
     20       4.4592      0.00000

 k-point 471 :       0.2500    0.4167    0.3750
  band No.  band energies     occupation 
      1       0.0396      0.00000
      2      -2.2894      0.00000
      3       2.7481      0.00000
      4      -0.5365      0.00000
      5       6.5804      0.00000
      6      -5.0887      0.00000
      7       1.2320      0.00000
      8      -2.0745      0.00000
      9       5.0146      0.00000
     10      -5.3090      0.00000
     11       0.5670      0.00000
     12      -0.5818      0.00000
     13       2.2450      0.00000
     14      -6.5771      0.00000
     15      -6.9726      0.00000
     16      -6.5633      0.00000
     17       9.8115      0.00000
     18       3.3732      0.00000
     19      11.1478      0.00000
     20      -4.4053      0.00000

 k-point 472 :       0.1667   -0.2500    0.1250
  band No.  band energies     occupation 
      1      -0.0369      0.00000
      2       3.0377      0.00000
      3      -6.2571      0.00000
      4       2.8409      0.00000
      5       1.9346      0.00000
      6      -6.5789      0.00000
      7       1.2330      0.00000
      8      -3.1924      0.00000
      9       5.2228      0.00000
     10       1.3696      0.00000
     11       2.7527      0.00000
     12       0.5429      0.00000
     13       2.5871      0.00000
     14      -0.9647      0.00000
     15      -0.1963      0.00000
     16       2.2683      0.00000
     17       1.3860      0.00000
     18      -4.1383      0.00000
     19      -5.5896      0.00000
     20      -3.3943      0.00000

 k-point 473 :       0.0417   -0.2917   -0.2917
  band No.  band energies     occupation 
      1       0.0005      0.00000
      2      -0.1690      0.00000
      3      -5.5781      0.00000
      4       5.7510      0.00000
      5       0.3081      0.00000
      6      -0.2766      0.00000
      7      -7.2645      0.00000
      8       7.1001      0.00000
      9       0.7539      0.00000
     10      -0.6231      0.00000
     11       0.3432      0.00000
     12      -0.8209      0.00000
     13       1.4856      0.00000
     14      -2.9356      0.00000
     15      -1.6138      0.00000
     16       3.4008      0.00000
     17      -0.3532      0.00000
     18       0.4365      0.00000
     19       0.2512      0.00000
     20      -8.2294      0.00000

 k-point 474 :      -0.3333   -0.3333   -0.0417
  band No.  band energies     occupation 
      1      -0.0022      0.00000
      2      -3.4625      0.00000
      3       4.0351      0.00000
      4      -0.1841      0.00000
      5      -0.6330      0.00000
      6       0.5659      0.00000
      7       1.3641      0.00000
      8      -0.6174      0.00000
      9       0.8158      0.00000
     10      -1.2224      0.00000
     11      -5.7279      0.00000
     12       2.7872      0.00000
     13       4.2035      0.00000
     14      -3.1366      0.00000
     15      -0.8803      0.00000
     16      -0.0607      0.00000
     17       0.9574      0.00000
     18       2.0738      0.00000
     19       0.0409      0.00000
     20      -5.4528      0.00000

 k-point 475 :       0.0000    0.3333    0.2917
  band No.  band energies     occupation 
      1      -0.0005      0.00000
      2       0.1690      0.00000
      3       5.5781      0.00000
      4      -5.7510      0.00000
      5      -0.3081      0.00000
      6       0.2766      0.00000
      7       7.2645      0.00000
      8      -7.1001      0.00000
      9      -0.7539      0.00000
     10       0.6231      0.00000
     11      -0.3432      0.00000
     12       0.8209      0.00000
     13      -1.4856      0.00000
     14       2.9356      0.00000
     15       1.6138      0.00000
     16      -3.4008      0.00000
     17       0.3532      0.00000
     18      -0.4365      0.00000
     19      -0.2512      0.00000
     20       8.2294      0.00000

 k-point 476 :       0.0417   -0.2083   -0.2917
  band No.  band energies     occupation 
      1       0.0008      0.00000
      2       1.5977      0.00000
      3      -2.1388      0.00000
      4       0.5792      0.00000
      5      -0.8074      0.00000
      6       0.6369      0.00000
      7       0.2262      0.00000
      8       0.0824      0.00000
      9      -1.3100      0.00000
     10       1.0216      0.00000
     11       0.0217      0.00000
     12      -1.7400      0.00000
     13       2.7705      0.00000
     14       0.2963      0.00000
     15      -1.8954      0.00000
     16       0.9770      0.00000
     17       1.1544      0.00000
     18      -1.3402      0.00000
     19      -0.5763      0.00000
     20       7.4302      0.00000

 k-point 477 :      -0.2917    0.0417   -0.2083
  band No.  band energies     occupation 
      1      -0.0065      0.00000
      2      -4.0364      0.00000
      3       4.3873      0.00000
      4       0.0259      0.00000
      5      -0.5416      0.00000
      6       0.6607      0.00000
      7       0.6307      0.00000
      8       0.1030      0.00000
      9       0.4079      0.00000
     10      -1.1399      0.00000
     11      -2.6899      0.00000
     12       0.1115      0.00000
     13       3.3166      0.00000
     14      -2.7611      0.00000
     15      -2.3088      0.00000
     16       1.4794      0.00000
     17       1.0454      0.00000
     18       1.7203      0.00000
     19       0.3584      0.00000
     20      -1.1822      0.00000

 k-point 478 :      -0.3333   -0.2500   -0.0417
  band No.  band energies     occupation 
      1      -0.0214      0.00000
      2      -7.2942      0.00000
      3      -0.9953      0.00000
      4       9.7745      0.00000
      5      -2.0868      0.00000
      6       2.8401      0.00000
      7      -1.0349      0.00000
      8       2.0303      0.00000
      9       1.4982      0.00000
     10      -3.0442      0.00000
     11      -8.5195      0.00000
     12       4.4395      0.00000
     13       3.6537      0.00000
     14      -6.1919      0.00000
     15      -0.6278      0.00000
     16      -1.3331      0.00000
     17       3.4812      0.00000
     18       5.3251      0.00000
     19       0.7306      0.00000
     20      -2.3818      0.00000

 k-point 479 :       0.0833    0.3333    0.2917
  band No.  band energies     occupation 
      1      -0.0008      0.00000
      2      -1.5977      0.00000
      3       2.1388      0.00000
      4      -0.5792      0.00000
      5       0.8074      0.00000
      6      -0.6369      0.00000
      7      -0.2262      0.00000
      8      -0.0824      0.00000
      9       1.3100      0.00000
     10      -1.0216      0.00000
     11      -0.0217      0.00000
     12       1.7400      0.00000
     13      -2.7705      0.00000
     14      -0.2963      0.00000
     15       1.8954      0.00000
     16      -0.9770      0.00000
     17      -1.1544      0.00000
     18       1.3402      0.00000
     19       0.5763      0.00000
     20      -7.4302      0.00000

 k-point 480 :       0.2500   -0.0833    0.2083
  band No.  band energies     occupation 
      1       0.0065      0.00000
      2       4.0364      0.00000
      3      -4.3873      0.00000
      4      -0.0259      0.00000
      5       0.5416      0.00000
      6      -0.6607      0.00000
      7      -0.6307      0.00000
      8      -0.1030      0.00000
      9      -0.4079      0.00000
     10       1.1399      0.00000
     11       2.6899      0.00000
     12      -0.1115      0.00000
     13      -3.3166      0.00000
     14       2.7611      0.00000
     15       2.3088      0.00000
     16      -1.4794      0.00000
     17      -1.0454      0.00000
     18      -1.7203      0.00000
     19      -0.3584      0.00000
     20       1.1822      0.00000

 k-point 481 :       0.0417   -0.1250   -0.2917
  band No.  band energies     occupation 
      1       0.0077      0.00000
      2       2.6473      0.00000
      3      -4.8174      0.00000
      4       2.4130      0.00000
      5      -3.4908      0.00000
      6       1.6821      0.00000
      7       0.0121      0.00000
      8       1.2402      0.00000
      9      -4.7662      0.00000
     10       4.9076      0.00000
     11      -0.0007      0.00000
     12      -0.3423      0.00000
     13       3.7002      0.00000
     14      -3.0373      0.00000
     15      -1.5364      0.00000
     16       2.2374      0.00000
     17       5.1683      0.00000
     18      -1.8423      0.00000
     19      -6.7699      0.00000
     20       3.0851      0.00000

 k-point 482 :      -0.2917    0.0417   -0.1250
  band No.  band energies     occupation 
      1      -0.0206      0.00000
      2      -3.8201      0.00000
      3       4.1340      0.00000
      4       0.4208      0.00000
      5      -1.1434      0.00000
      6       3.0939      0.00000
      7      -0.3471      0.00000
      8       1.8508      0.00000
      9      -0.8358      0.00000
     10      -3.1985      0.00000
     11      -2.9123      0.00000
     12       0.9306      0.00000
     13       3.0883      0.00000
     14      -3.3251      0.00000
     15      -4.9160      0.00000
     16      -0.9072      0.00000
     17       3.1016      0.00000
     18       1.9933      0.00000
     19       4.1111      0.00000
     20      -0.5152      0.00000

 k-point 483 :      -0.3333   -0.1667   -0.0417
  band No.  band energies     occupation 
      1      -0.0377      0.00000
      2      -4.4222      0.00000
      3      -3.7394      0.00000
      4      10.4522      0.00000
      5      -3.5085      0.00000
      6       2.7281      0.00000
      7       3.7934      0.00000
      8       0.1040      0.00000
      9       0.9991      0.00000
     10      -4.2914      0.00000
     11      -7.0008      0.00000
     12       2.3147      0.00000
     13       1.8815      0.00000
     14      -2.5272      0.00000
     15      -6.3609      0.00000
     16      -2.4338      0.00000
     17       5.4901      0.00000
     18       2.6920      0.00000
     19       5.8518      0.00000
     20      -0.8160      0.00000

 k-point 484 :       0.1667    0.3333    0.2917
  band No.  band energies     occupation 
      1      -0.0077      0.00000
      2      -2.6473      0.00000
      3       4.8174      0.00000
      4      -2.4130      0.00000
      5       3.4908      0.00000
      6      -1.6822      0.00000
      7      -0.0121      0.00000
      8      -1.2402      0.00000
      9       4.7662      0.00000
     10      -4.9076      0.00000
     11       0.0007      0.00000
     12       0.3423      0.00000
     13      -3.7002      0.00000
     14       3.0373      0.00000
     15       1.5364      0.00000
     16      -2.2374      0.00000
     17      -5.1683      0.00000
     18       1.8423      0.00000
     19       6.7699      0.00000
     20      -3.0851      0.00000

 k-point 485 :       0.1667   -0.1667    0.1250
  band No.  band energies     occupation 
      1       0.0206      0.00000
      2       3.8201      0.00000
      3      -4.1340      0.00000
      4      -0.4208      0.00000
      5       1.1434      0.00000
      6      -3.0939      0.00000
      7       0.3471      0.00000
      8      -1.8508      0.00000
      9       0.8358      0.00000
     10       3.1984      0.00000
     11       2.9123      0.00000
     12      -0.9306      0.00000
     13      -3.0883      0.00000
     14       3.3251      0.00000
     15       4.9160      0.00000
     16       0.9072      0.00000
     17      -3.1016      0.00000
     18      -1.9933      0.00000
     19      -4.1111      0.00000
     20       0.5152      0.00000

 k-point 486 :       0.0417   -0.2083   -0.2083
  band No.  band energies     occupation 
      1      -0.0009      0.00000
      2      -3.3039      0.00000
      3       6.8339      0.00000
      4      -3.5655      0.00000
      5       0.2640      0.00000
      6       5.9771      0.00000
      7      -6.7574      0.00000
      8       0.5351      0.00000
      9       0.1347      0.00000
     10      -0.0693      0.00000
     11      -0.6683      0.00000
     12       5.1683      0.00000
     13      -6.1086      0.00000
     14       1.5191      0.00000
     15       7.2694      0.00000
     16      -7.3159      0.00000
     17      -0.6231      0.00000
     18       0.3056      0.00000
     19       0.5802      0.00000
     20      -9.0122      0.00000

 k-point 487 :      -0.2500   -0.2500   -0.0417
  band No.  band energies     occupation 
      1      -0.0103      0.00000
      2      -6.5717      0.00000
      3      -0.2765      0.00000
      4       7.5475      0.00000
      5      -0.8289      0.00000
      6       3.9897      0.00000
      7       1.3556      0.00000
      8      -4.0356      0.00000
      9       0.1514      0.00000
     10      -0.9032      0.00000
     11      -4.9944      0.00000
     12       3.2460      0.00000
     13       3.8581      0.00000
     14      -3.5417      0.00000
     15      -0.9743      0.00000
     16      -0.8487      0.00000
     17       1.7946      0.00000
     18       0.3928      0.00000
     19       1.6684      0.00000
     20      -3.2722      0.00000

 k-point 488 :       0.0000    0.2500    0.2083
  band No.  band energies     occupation 
      1       0.0009      0.00000
      2       3.3039      0.00000
      3      -6.8339      0.00000
      4       3.5655      0.00000
      5      -0.2640      0.00000
      6      -5.9771      0.00000
      7       6.7574      0.00000
      8      -0.5351      0.00000
      9      -0.1347      0.00000
     10       0.0693      0.00000
     11       0.6683      0.00000
     12      -5.1683      0.00000
     13       6.1086      0.00000
     14      -1.5191      0.00000
     15      -7.2694      0.00000
     16       7.3159      0.00000
     17       0.6231      0.00000
     18      -0.3056      0.00000
     19      -0.5802      0.00000
     20       9.0122      0.00000

 k-point 489 :       0.0417   -0.1250   -0.2083
  band No.  band energies     occupation 
      1       0.0034      0.00000
      2       3.4167      0.00000
      3      -5.0502      0.00000
      4       1.7507      0.00000
      5      -0.7701      0.00000
      6      -0.0609      0.00000
      7       0.3682      0.00000
      8       0.1704      0.00000
      9       0.1588      0.00000
     10      -0.0333      0.00000
     11       0.6255      0.00000
     12      -3.1209      0.00000
     13       4.2850      0.00000
     14      -1.7729      0.00000
     15      -4.6356      0.00000
     16       4.4885      0.00000
     17       2.5933      0.00000
     18      -1.2529      0.00000
     19      -1.9528      0.00000
     20       2.3491      0.00000

 k-point 490 :      -0.2083    0.0417   -0.1250
  band No.  band energies     occupation 
      1      -0.0100      0.00000
      2      -4.3391      0.00000
      3       3.3636      0.00000
      4       1.5641      0.00000
      5      -0.6678      0.00000
      6       0.8992      0.00000
      7      -0.0264      0.00000
      8       0.5117      0.00000
      9      -0.2673      0.00000
     10      -0.9326      0.00000
     11      -1.6671      0.00000
     12       0.6576      0.00000
     13       1.7301      0.00000
     14      -1.6745      0.00000
     15      -0.0478      0.00000
     16      -2.6925      0.00000
     17       0.3605      0.00000
     18       2.3821      0.00000
     19       1.2727      0.00000
     20      -2.3566      0.00000

 k-point 491 :      -0.2500   -0.1667   -0.0417
  band No.  band energies     occupation 
      1      -0.0302      0.00000
      2      -7.3419      0.00000
      3      -1.8211      0.00000
      4      11.6412      0.00000
      5      -3.1828      0.00000
      6       0.2980      0.00000
      7       3.0926      0.00000
      8       0.6983      0.00000
      9      -0.1906      0.00000
     10      -2.3263      0.00000
     11      -5.8106      0.00000
     12       3.3423      0.00000
     13       3.3851      0.00000
     14      -4.3761      0.00000
     15      -4.1575      0.00000
     16      -2.9298      0.00000
     17       1.4438      0.00000
     18       6.6085      0.00000
     19       2.9042      0.00000
     20      -4.6649      0.00000

 k-point 492 :       0.0833    0.2500    0.2083
  band No.  band energies     occupation 
      1      -0.0034      0.00000
      2      -3.4167      0.00000
      3       5.0502      0.00000
      4      -1.7507      0.00000
      5       0.7701      0.00000
      6       0.0609      0.00000
      7      -0.3682      0.00000
      8      -0.1704      0.00000
      9      -0.1588      0.00000
     10       0.0333      0.00000
     11      -0.6255      0.00000
     12       3.1209      0.00000
     13      -4.2850      0.00000
     14       1.7729      0.00000
     15       4.6356      0.00000
     16      -4.4886      0.00000
     17      -2.5933      0.00000
     18       1.2529      0.00000
     19       1.9528      0.00000
     20      -2.3491      0.00000

 k-point 493 :       0.1667   -0.0833    0.1250
  band No.  band energies     occupation 
      1       0.0100      0.00000
      2       4.3391      0.00000
      3      -3.3636      0.00000
      4      -1.5641      0.00000
      5       0.6678      0.00000
      6      -0.8992      0.00000
      7       0.0265      0.00000
      8      -0.5117      0.00000
      9       0.2673      0.00000
     10       0.9326      0.00000
     11       1.6671      0.00000
     12      -0.6576      0.00000
     13      -1.7301      0.00000
     14       1.6745      0.00000
     15       0.0478      0.00000
     16       2.6925      0.00000
     17      -0.3605      0.00000
     18      -2.3821      0.00000
     19      -1.2727      0.00000
     20       2.3566      0.00000

 k-point 494 :       0.0417   -0.1250   -0.1250
  band No.  band energies     occupation 
      1      -0.0013      0.00000
      2      -6.0158      0.00000
      3       8.9843      0.00000
      4      -3.0160      0.00000
      5       0.2924      0.00000
      6      -7.8556      0.00000
      7       7.7239      0.00000
      8       0.0128      0.00000
      9      -1.7232      0.00000
     10       1.5968      0.00000
     11      -1.9292      0.00000
     12       7.0125      0.00000
     13      -6.6470      0.00000
     14       1.5935      0.00000
     15      -0.0915      0.00000
     16      10.9665      0.00000
     17     -10.6460      0.00000
     18      -0.6426      0.00000
     19       0.9354      0.00000
     20      -1.8549      0.00000

 k-point 495 :      -0.1667   -0.1667   -0.0417
  band No.  band energies     occupation 
      1      -0.0092      0.00000
      2      -6.3550      0.00000
      3      -0.3592      0.00000
      4       7.8094      0.00000
      5      -1.3632      0.00000
      6       1.1343      0.00000
      7      -0.1949      0.00000
      8       0.4542      0.00000
      9      -0.3630      0.00000
     10      -0.7316      0.00000
     11      -3.7041      0.00000
     12       2.7416      0.00000
     13       2.8857      0.00000
     14      -2.7266      0.00000
     15       0.6747      0.00000
     16      -0.6662      0.00000
     17      -3.4489      0.00000
     18       3.7481      0.00000
     19       0.3113      0.00000
     20      -4.5157      0.00000

 k-point 496 :       0.0000    0.1667    0.1250
  band No.  band energies     occupation 
      1       0.0013      0.00000
      2       6.0158      0.00000
      3      -8.9843      0.00000
      4       3.0160      0.00000
      5      -0.2924      0.00000
      6       7.8556      0.00000
      7      -7.7239      0.00000
      8      -0.0128      0.00000
      9       1.7232      0.00000
     10      -1.5968      0.00000
     11       1.9292      0.00000
     12      -7.0125      0.00000
     13       6.6470      0.00000
     14      -1.5935      0.00000
     15       0.0915      0.00000
     16     -10.9665      0.00000
     17      10.6460      0.00000
     18       0.6426      0.00000
     19      -0.9354      0.00000
     20       1.8549      0.00000

 k-point 497 :       0.0000    0.0000   -0.1250
  band No.  band energies     occupation 
      1       0.0129      0.00000
      2       6.0881      0.00000
      3     -13.1654      0.00000
      4       5.5689      0.00000
      5      -6.5503      0.00000
      6      11.9242      0.00000
      7      -4.7899      0.00000
      8      -0.8368      0.00000
      9       1.1184      0.00000
     10       1.9308      0.00000
     11       2.9159      0.00000
     12      -5.1549      0.00000
     13      -3.3733      0.00000
     14       5.8758      0.00000
     15      -1.4859      0.00000
     16       9.0940      0.00000
     17     -13.0006      0.00000
     18       5.5666      0.00000
     19       1.1909      0.00000
     20       2.4209      0.00000

 k-point 498 :       0.1250    0.2083    0.1250
  band No.  band energies     occupation 
      1      -0.0066      0.00000
      2      -4.1755      0.00000
      3       4.8618      0.00000
      4      -0.5014      0.00000
      5       1.0990      0.00000
      6      -2.1840      0.00000
      7       1.4045      0.00000
      8       0.4490      0.00000
      9      -0.7606      0.00000
     10      -0.9145      0.00000
     11      -0.0010      0.00000
     12       1.7381      0.00000
     13      -1.6217      0.00000
     14       0.2546      0.00000
     15       0.1507      0.00000
     16       0.6257      0.00000
     17      -1.1466      0.00000
     18      -0.4849      0.00000
     19       1.2884      0.00000
     20      -0.5438      0.00000

 k-point 499 :       0.0000    0.0833   -0.1250
  band No.  band energies     occupation 
      1       0.0330      0.00000
      2       7.8859      0.00000
      3       2.0460      0.00000
      4     -14.1407      0.00000
      5      13.7024      0.00000
      6     -13.5713      0.00000
      7       1.5783      0.00000
      8      -1.6726      0.00000
      9       2.3990      0.00000
     10       1.9416      0.00000
     11       2.9973      0.00000
     12      -2.1062      0.00000
     13      -2.3987      0.00000
     14       6.1684      0.00000
     15      -4.5095      0.00000
     16      10.8984      0.00000
     17       3.3934      0.00000
     18     -12.5090      0.00000
     19       2.2351      0.00000
     20       4.6014      0.00000

 k-point 500 :       0.0833    0.0000   -0.1250
  band No.  band energies     occupation 
      1       0.0066      0.00000
      2       4.1755      0.00000
      3      -4.8618      0.00000
      4       0.5014      0.00000
      5      -1.0990      0.00000
      6       2.1840      0.00000
      7      -1.4045      0.00000
      8      -0.4490      0.00000
      9       0.7606      0.00000
     10       0.9145      0.00000
     11       0.0010      0.00000
     12      -1.7381      0.00000
     13       1.6217      0.00000
     14      -0.2546      0.00000
     15      -0.1507      0.00000
     16      -0.6257      0.00000
     17       1.1466      0.00000
     18       0.4849      0.00000
     19      -1.2884      0.00000
     20       0.5438      0.00000

 k-point 501 :       0.1250    0.2917    0.1250
  band No.  band energies     occupation 
      1       0.0072      0.00000
      2       3.1400      0.00000
      3      -3.6521      0.00000
      4       0.5355      0.00000
      5      -1.3731      0.00000
      6       0.8176      0.00000
      7      -0.1238      0.00000
      8      -0.5966      0.00000
      9       1.1120      0.00000
     10       1.1655      0.00000
     11      -0.7981      0.00000
     12      -0.3523      0.00000
     13       0.5563      0.00000
     14      -0.0284      0.00000
     15      -0.0522      0.00000
     16       0.3459      0.00000
     17       0.4953      0.00000
     18       0.4432      0.00000
     19      -1.9938      0.00000
     20      -0.2589      0.00000

 k-point 502 :       0.0000    0.1667   -0.1250
  band No.  band energies     occupation 
      1       0.0526      0.00000
      2       6.8763      0.00000
      3       1.4985      0.00000
      4     -12.8308      0.00000
      5      13.6755      0.00000
      6      -1.1632      0.00000
      7     -12.8066      0.00000
      8      -1.2161      0.00000
      9       0.3871      0.00000
     10       4.0194      0.00000
     11       4.0956      0.00000
     12      -0.7170      0.00000
     13      -0.4114      0.00000
     14       6.7747      0.00000
     15       6.5015      0.00000
     16       0.3654      0.00000
     17      -1.1830      0.00000
     18     -10.7184      0.00000
     19      -1.0818      0.00000
     20       3.0861      0.00000

 k-point 503 :       0.1667   -0.0000   -0.1250
  band No.  band energies     occupation 
      1      -0.0072      0.00000
      2      -3.1400      0.00000
      3       3.6521      0.00000
      4      -0.5355      0.00000
      5       1.3731      0.00000
      6      -0.8176      0.00000
      7       0.1238      0.00000
      8       0.5966      0.00000
      9      -1.1120      0.00000
     10      -1.1655      0.00000
     11       0.7981      0.00000
     12       0.3523      0.00000
     13      -0.5563      0.00000
     14       0.0284      0.00000
     15       0.0522      0.00000
     16      -0.3459      0.00000
     17      -0.4953      0.00000
     18      -0.4432      0.00000
     19       1.9938      0.00000
     20       0.2589      0.00000

 k-point 504 :       0.1250    0.3750    0.1250
  band No.  band energies     occupation 
      1       0.0083      0.00000
      2       2.8544      0.00000
      3      -4.0506      0.00000
      4       1.3782      0.00000
      5      -4.2903      0.00000
      6       0.4985      0.00000
      7       1.4611      0.00000
      8      -2.2190      0.00000
      9       3.7028      0.00000
     10       3.7957      0.00000
     11      -3.1217      0.00000
     12       0.5936      0.00000
     13       0.0647      0.00000
     14       0.7826      0.00000
     15       4.8034      0.00000
     16       3.4462      0.00000
     17      -3.3438      0.00000
     18      -1.6829      0.00000
     19      -1.9176      0.00000
     20      -5.8531      0.00000

 k-point 505 :       0.0000    0.2500   -0.1250
  band No.  band energies     occupation 
      1       0.0449      0.00000
      2       3.9046      0.00000
      3       3.6953      0.00000
      4     -11.0975      0.00000
      5      13.2800      0.00000
      6      -4.4213      0.00000
      7     -11.5287      0.00000
      8      -1.0553      0.00000
      9      -1.3442      0.00000
     10       5.9443      0.00000
     11       3.6968      0.00000
     12       2.3089      0.00000
     13       1.9989      0.00000
     14       2.7386      0.00000
     15      -5.8864      0.00000
     16       4.9102      0.00000
     17       6.3272      0.00000
     18      -7.8048      0.00000
     19      -2.1009      0.00000
     20      -4.8581      0.00000

 k-point 506 :       0.2500    0.0000   -0.1250
  band No.  band energies     occupation 
      1      -0.0082      0.00000
      2      -2.8544      0.00000
      3       4.0506      0.00000
      4      -1.3782      0.00000
      5       4.2903      0.00000
      6      -0.4985      0.00000
      7      -1.4611      0.00000
      8       2.2190      0.00000
      9      -3.7028      0.00000
     10      -3.7957      0.00000
     11       3.1217      0.00000
     12      -0.5936      0.00000
     13      -0.0647      0.00000
     14      -0.7826      0.00000
     15      -4.8034      0.00000
     16      -3.4462      0.00000
     17       3.3438      0.00000
     18       1.6829      0.00000
     19       1.9176      0.00000
     20       5.8531      0.00000

 k-point 507 :       0.1250    0.4583    0.1250
  band No.  band energies     occupation 
      1      -0.0937      0.00000
      2       2.5273      0.00000
      3      -4.0884      0.00000
      4       1.8488      0.00000
      5       0.9719      0.00000
      6      -6.5594      0.00000
      7       1.7902      0.00000
      8      -4.3136      0.00000
      9       6.8494      0.00000
     10       6.1135      0.00000
     11      -5.2112      0.00000
     12       0.7380      0.00000
     13       1.2348      0.00000
     14       4.4964      0.00000
     15       3.6102      0.00000
     16       1.5316      0.00000
     17      -3.4160      0.00000
     18      -3.6974      0.00000
     19      -2.6093      0.00000
     20      -6.8932      0.00000

 k-point 508 :       0.0000    0.3333   -0.1250
  band No.  band energies     occupation 
      1      -0.0888      0.00000
      2       2.9487      0.00000
      3       4.4823      0.00000
      4      -9.7429      0.00000
      5      -7.2366      0.00000
      6      12.7256      0.00000
      7      -8.2206      0.00000
      8      -3.6449      0.00000
      9       8.4119      0.00000
     10      -2.7023      0.00000
     11       0.0062      0.00000
     12       8.5714      0.00000
     13      -0.1707      0.00000
     14      -3.2970      0.00000
     15       8.4803      0.00000
     16      -1.6587      0.00000
     17       9.1727      0.00000
     18      -8.1865      0.00000
     19      -6.5490      0.00000
     20     -10.3038      0.00000

 k-point 509 :       0.3333    0.0000   -0.1250
  band No.  band energies     occupation 
      1       0.0937      0.00000
      2      -2.5273      0.00000
      3       4.0884      0.00000
      4      -1.8488      0.00000
      5      -0.9719      0.00000
      6       6.5594      0.00000
      7      -1.7902      0.00000
      8       4.3136      0.00000
      9      -6.8494      0.00000
     10      -6.1135      0.00000
     11       5.2112      0.00000
     12      -0.7380      0.00000
     13      -1.2348      0.00000
     14      -4.4964      0.00000
     15      -3.6102      0.00000
     16      -1.5316      0.00000
     17       3.4160      0.00000
     18       3.6974      0.00000
     19       2.6093      0.00000
     20       6.8932      0.00000

 k-point 510 :       0.1250   -0.4583    0.1250
  band No.  band energies     occupation 
      1      -0.8632      0.00000
      2       3.1336      0.00000
      3      -4.2936      0.00000
      4       2.0267      0.00000
      5       1.4631      0.00000
      6      -7.7260      0.00000
      7       1.6807      0.00000
      8      -6.5268      0.00000
      9      10.1567      0.00000
     10       8.1615      0.00000
     11      -5.8247      0.00000
     12      -0.2591      0.00000
     13       2.3585      0.00000
     14       4.0905      0.00000
     15       3.5962      0.00000
     16       2.6230      0.00000
     17      -5.8387      0.00000
     18      -1.2674      0.00000
     19      -1.2752      0.00000
     20     -10.1355      0.00000

 k-point 511 :       0.0000   -0.5833   -0.1250
  band No.  band energies     occupation 
      1      -0.8997      0.00000
      2       3.2510      0.00000
      3       4.9764      0.00000
      4      -8.7811      0.00000
      5      -8.4826      0.00000
      6      11.8629      0.00000
      7      -5.8676      0.00000
      8      -5.1705      0.00000
      9       9.1046      0.00000
     10      -3.6525      0.00000
     11      -4.0620      0.00000
     12      11.9352      0.00000
     13       2.1325      0.00000
     14      -1.0391      0.00000
     15       8.5090      0.00000
     16      -5.0508      0.00000
     17      13.3366      0.00000
     18      -2.1347      0.00000
     19     -10.7341      0.00000
     20      -6.7104      0.00000

 k-point 512 :      -0.5833    0.0000   -0.1250
  band No.  band energies     occupation 
      1       0.8632      0.00000
      2      -3.1336      0.00000
      3       4.2936      0.00000
      4      -2.0267      0.00000
      5      -1.4631      0.00000
      6       7.7260      0.00000
      7      -1.6807      0.00000
      8       6.5268      0.00000
      9     -10.1567      0.00000
     10      -8.1615      0.00000
     11       5.8247      0.00000
     12       0.2591      0.00000
     13      -2.3585      0.00000
     14      -4.0905      0.00000
     15      -3.5962      0.00000
     16      -2.6230      0.00000
     17       5.8387      0.00000
     18       1.2674      0.00000
     19       1.2752      0.00000
     20      10.1355      0.00000

 k-point 513 :       0.1250   -0.3750    0.1250
  band No.  band energies     occupation 
      1      -0.8969      0.00000
      2       3.2628      0.00000
      3      -4.7075      0.00000
      4       1.9893      0.00000
      5       1.8950      0.00000
      6      -8.0114      0.00000
      7       1.4144      0.00000
      8      -5.9366      0.00000
      9       9.9295      0.00000
     10      -3.5975      0.00000
     11      10.4325      0.00000
     12      -2.3566      0.00000
     13       2.4909      0.00000
     14       1.1811      0.00000
     15       3.8330      0.00000
     16      -3.8254      0.00000
     17       7.6519      0.00000
     18       0.4900      0.00000
     19      -8.6235      0.00000
     20     -13.3359      0.00000

 k-point 514 :       0.0000   -0.5000   -0.1250
  band No.  band energies     occupation 
      1      -0.8530      0.00000
      2       3.0177      0.00000
      3       5.3244      0.00000
      4      -8.1226      0.00000
      5      -8.6842      0.00000
      6      10.8465      0.00000
      7      -5.0008      0.00000
      8      -1.9870      0.00000
      9       4.2780      0.00000
     10      -2.8468      0.00000
     11      -4.0978      0.00000
     12       8.9969      0.00000
     13       0.0667      0.00000
     14       5.6714      0.00000
     15       7.2187      0.00000
     16       9.3568      0.00000
     17     -10.1379      0.00000
     18      -9.9555      0.00000
     19     -17.1914      0.00000
     20       4.8992      0.00000

 k-point 515 :      -0.5000    0.0000   -0.1250
  band No.  band energies     occupation 
      1       0.8969      0.00000
      2      -3.2628      0.00000
      3       4.7075      0.00000
      4      -1.9893      0.00000
      5      -1.8950      0.00000
      6       8.0114      0.00000
      7      -1.4144      0.00000
      8       5.9366      0.00000
      9      -9.9295      0.00000
     10       3.5975      0.00000
     11     -10.4325      0.00000
     12       2.3566      0.00000
     13      -2.4909      0.00000
     14      -1.1811      0.00000
     15      -3.8330      0.00000
     16       3.8254      0.00000
     17      -7.6519      0.00000
     18      -0.4900      0.00000
     19       8.6235      0.00000
     20      13.3359      0.00000

 k-point 516 :       0.1250   -0.2917    0.1250
  band No.  band energies     occupation 
      1      -0.0945      0.00000
      2       2.8512      0.00000
      3       1.7863      0.00000
      4      -5.3675      0.00000
      5       2.2382      0.00000
      6      -7.5235      0.00000
      7       1.0561      0.00000
      8      -3.6529      0.00000
      9       7.1425      0.00000
     10      -0.6508      0.00000
     11      10.7611      0.00000
     12      -4.6143      0.00000
     13       1.9681      0.00000
     14      -0.8532      0.00000
     15       6.0148      0.00000
     16      -3.5892      0.00000
     17       3.6747      0.00000
     18      -4.7802      0.00000
     19      -7.4792      0.00000
     20      -5.4702      0.00000

 k-point 517 :       0.0000   -0.4167   -0.1250
  band No.  band energies     occupation 
      1      -0.0931      0.00000
      2       2.3214      0.00000
      3      -7.7519      0.00000
      4       5.4849      0.00000
      5      -7.7471      0.00000
      6       9.7767      0.00000
      7      -5.1768      0.00000
      8       1.0507      0.00000
      9      -1.2969      0.00000
     10       2.6543      0.00000
     11      -2.3612      0.00000
     12       3.3151      0.00000
     13      -1.5744      0.00000
     14       7.2721      0.00000
     15       7.0845      0.00000
     16       7.2752      0.00000
     17     -11.7624      0.00000
     18      -4.0494      0.00000
     19     -14.0921      0.00000
     20       4.8303      0.00000

 k-point 518 :      -0.4167    0.0000   -0.1250
  band No.  band energies     occupation 
      1       0.0945      0.00000
      2      -2.8512      0.00000
      3      -1.7863      0.00000
      4       5.3675      0.00000
      5      -2.2382      0.00000
      6       7.5235      0.00000
      7      -1.0561      0.00000
      8       3.6529      0.00000
      9      -7.1426      0.00000
     10       0.6508      0.00000
     11     -10.7611      0.00000
     12       4.6143      0.00000
     13      -1.9681      0.00000
     14       0.8532      0.00000
     15      -6.0148      0.00000
     16       3.5892      0.00000
     17      -3.6747      0.00000
     18       4.7802      0.00000
     19       7.4792      0.00000
     20       5.4702      0.00000

 k-point 519 :       0.1250   -0.2083    0.1250
  band No.  band energies     occupation 
      1       0.0263      0.00000
      2       3.5155      0.00000
      3       1.4467      0.00000
      4      -6.3446      0.00000
      5       2.3745      0.00000
      6      -6.0770      0.00000
      7       0.8734      0.00000
      8      -2.0677      0.00000
      9       3.5248      0.00000
     10       1.4636      0.00000
     11       8.8335      0.00000
     12      -5.1367      0.00000
     13      -0.7902      0.00000
     14      -0.1949      0.00000
     15       9.0559      0.00000
     16       1.8953      0.00000
     17      -4.6918      0.00000
     18      -3.2984      0.00000
     19      -5.5480      0.00000
     20      -1.6172      0.00000

 k-point 520 :       0.0000   -0.3333   -0.1250
  band No.  band energies     occupation 
      1       0.0071      0.00000
      2       2.5589      0.00000
      3      -7.6919      0.00000
      4       5.4122      0.00000
      5      -5.2919      0.00000
      6       8.6625      0.00000
      7      -6.0248      0.00000
      8       1.4181      0.00000
      9      -9.8608      0.00000
     10      10.6476      0.00000
     11      -0.1265      0.00000
     12       0.3054      0.00000
     13      -5.9054      0.00000
     14       7.9912      0.00000
     15       0.9021      0.00000
     16       3.8182      0.00000
     17       1.1850      0.00000
     18      -2.0659      0.00000
     19     -10.0959      0.00000
     20       2.5874      0.00000

 k-point 521 :      -0.3333    0.0000   -0.1250
  band No.  band energies     occupation 
      1      -0.0263      0.00000
      2      -3.5155      0.00000
      3      -1.4467      0.00000
      4       6.3446      0.00000
      5      -2.3745      0.00000
      6       6.0770      0.00000
      7      -0.8734      0.00000
      8       2.0677      0.00000
      9      -3.5248      0.00000
     10      -1.4636      0.00000
     11      -8.8335      0.00000
     12       5.1367      0.00000
     13       0.7902      0.00000
     14       0.1949      0.00000
     15      -9.0559      0.00000
     16      -1.8953      0.00000
     17       4.6918      0.00000
     18       3.2984      0.00000
     19       5.5480      0.00000
     20       1.6172      0.00000

 k-point 522 :       0.1250   -0.1250    0.1250
  band No.  band energies     occupation 
      1       0.0286      0.00000
      2       4.8592      0.00000
      3       0.9772      0.00000
      4      -7.6064      0.00000
      5       2.3031      0.00000
      6       0.7467      0.00000
      7      -3.7228      0.00000
      8      -1.2436      0.00000
      9       0.5203      0.00000
     10       2.6326      0.00000
     11       6.3686      0.00000
     12      -4.5646      0.00000
     13      -3.4234      0.00000
     14       4.9028      0.00000
     15       2.0932      0.00000
     16       4.8998      0.00000
     17      -2.9078      0.00000
     18      -4.5142      0.00000
     19      -3.0549      0.00000
     20       2.7323      0.00000

 k-point 523 :       0.0000   -0.2500   -0.1250
  band No.  band energies     occupation 
      1       0.0095      0.00000
      2       3.3957      0.00000
      3      -8.0380      0.00000
      4       4.9109      0.00000
      5      -2.2301      0.00000
      6      -6.8576      0.00000
      7       7.8104      0.00000
      8       0.4120      0.00000
      9       0.5102      0.00000
     10       0.0122      0.00000
     11       1.5462      0.00000
     12      -2.7177      0.00000
     13       6.0234      0.00000
     14      -4.8119      0.00000
     15      -7.6434      0.00000
     16       7.6304      0.00000
     17      12.8762      0.00000
     18      -9.6321      0.00000
     19      -5.3114      0.00000
     20       2.9888      0.00000

 k-point 524 :      -0.2500    0.0000   -0.1250
  band No.  band energies     occupation 
      1      -0.0286      0.00000
      2      -4.8592      0.00000
      3      -0.9772      0.00000
      4       7.6064      0.00000
      5      -2.3031      0.00000
      6      -0.7467      0.00000
      7       3.7228      0.00000
      8       1.2436      0.00000
      9      -0.5203      0.00000
     10      -2.6326      0.00000
     11      -6.3686      0.00000
     12       4.5646      0.00000
     13       3.4234      0.00000
     14      -4.9028      0.00000
     15      -2.0932      0.00000
     16      -4.8998      0.00000
     17       2.9078      0.00000
     18       4.5142      0.00000
     19       3.0549      0.00000
     20      -2.7323      0.00000

 k-point 525 :       0.1250    0.2083    0.2083
  band No.  band energies     occupation 
      1      -0.0112      0.00000
      2      -4.0623      0.00000
      3       9.3028      0.00000
      4      -5.4109      0.00000
      5       2.5012      0.00000
      6      -8.6255      0.00000
      7       7.2859      0.00000
      8       0.2789      0.00000
      9      -7.2896      0.00000
     10       5.7565      0.00000
     11      -2.1517      0.00000
     12       3.6630      0.00000
     13      -6.0478      0.00000
     14       4.9231      0.00000
     15      -1.1581      0.00000
     16       9.5425      0.00000
     17      -7.7003      0.00000
     18      -3.5405      0.00000
     19       5.2241      0.00000
     20      -1.4551      0.00000

 k-point 526 :       0.0833    0.0833   -0.1250
  band No.  band energies     occupation 
      1       0.0260      0.00000
      2       5.0894      0.00000
      3       1.0727      0.00000
      4      -8.2009      0.00000
      5       3.0561      0.00000
      6      -3.3494      0.00000
      7       0.3391      0.00000
      8      -1.5062      0.00000
      9       1.3987      0.00000
     10       2.2159      0.00000
     11       5.0193      0.00000
     12      -4.5130      0.00000
     13      -2.5732      0.00000
     14       4.4892      0.00000
     15      -1.8750      0.00000
     16       1.7948      0.00000
     17       6.8119      0.00000
     18      -6.8189      0.00000
     19      -1.2011      0.00000
     20       2.3785      0.00000

 k-point 527 :       0.0000   -0.0833   -0.2083
  band No.  band energies     occupation 
      1       0.0112      0.00000
      2       4.0623      0.00000
      3      -9.3028      0.00000
      4       5.4109      0.00000
      5      -2.5012      0.00000
      6       8.6255      0.00000
      7      -7.2859      0.00000
      8      -0.2789      0.00000
      9       7.2896      0.00000
     10      -5.7565      0.00000
     11       2.1517      0.00000
     12      -3.6630      0.00000
     13       6.0478      0.00000
     14      -4.9231      0.00000
     15       1.1581      0.00000
     16      -9.5425      0.00000
     17       7.7003      0.00000
     18       3.5405      0.00000
     19      -5.2241      0.00000
     20       1.4551      0.00000

 k-point 528 :       0.1250    0.2917    0.2083
  band No.  band energies     occupation 
      1      -0.0049      0.00000
      2      -2.8813      0.00000
      3       3.6453      0.00000
      4      -0.8875      0.00000
      5       1.2673      0.00000
      6      -0.4316      0.00000
      7      -0.1705      0.00000
      8      -0.1418      0.00000
      9      -0.1036      0.00000
     10      -0.4409      0.00000
     11       0.0095      0.00000
     12       1.2799      0.00000
     13      -2.1584      0.00000
     14       0.9282      0.00000
     15       2.5394      0.00000
     16      -2.4711      0.00000
     17      -6.8574      0.00000
     18       5.2565      0.00000
     19       2.6545      0.00000
     20      -0.7891      0.00000

 k-point 529 :       0.2083    0.1250    0.2917
  band No.  band energies     occupation 
      1      -0.0089      0.00000
      2      -3.5167      0.00000
      3       3.7453      0.00000
      4       0.0254      0.00000
      5      -0.2074      0.00000
      6       1.0049      0.00000
      7      -0.3574      0.00000
      8       0.7813      0.00000
      9      -0.6925      0.00000
     10      -1.1951      0.00000
     11      -0.1920      0.00000
     12      -0.1976      0.00000
     13       0.9161      0.00000
     14      -1.2149      0.00000
     15       0.2692      0.00000
     16      -2.4607      0.00000
     17       0.8355      0.00000
     18       1.2624      0.00000
     19       1.4252      0.00000
     20      -0.6809      0.00000

 k-point 530 :       0.0833    0.1667   -0.1250
  band No.  band energies     occupation 
      1       0.0463      0.00000
      2       6.9790      0.00000
      3       1.5132      0.00000
      4     -12.0663      0.00000
      5       5.8904      0.00000
      6      -0.9848      0.00000
      7      -5.8266      0.00000
      8      -0.5970      0.00000
      9      -0.2131      0.00000
     10       3.6711      0.00000
     11       4.9208      0.00000
     12      -1.4146      0.00000
     13      -1.1706      0.00000
     14       4.3883      0.00000
     15       4.8606      0.00000
     16       4.4842      0.00000
     17      -8.2174      0.00000
     18      -3.3960      0.00000
     19      -3.3543      0.00000
     20       3.6294      0.00000

 k-point 531 :       0.0833   -0.0833   -0.2083
  band No.  band energies     occupation 
      1       0.0049      0.00000
      2       2.8813      0.00000
      3      -3.6453      0.00000
      4       0.8875      0.00000
      5      -1.2673      0.00000
      6       0.4316      0.00000
      7       0.1705      0.00000
      8       0.1418      0.00000
      9       0.1036      0.00000
     10       0.4409      0.00000
     11      -0.0095      0.00000
     12      -1.2799      0.00000
     13       2.1584      0.00000
     14      -0.9282      0.00000
     15      -2.5394      0.00000
     16       2.4711      0.00000
     17       6.8574      0.00000
     18      -5.2565      0.00000
     19      -2.6545      0.00000
     20       0.7891      0.00000

 k-point 532 :      -0.1667   -0.0833   -0.2917
  band No.  band energies     occupation 
      1       0.0089      0.00000
      2       3.5167      0.00000
      3      -3.7453      0.00000
      4      -0.0254      0.00000
      5       0.2074      0.00000
      6      -1.0049      0.00000
      7       0.3574      0.00000
      8      -0.7813      0.00000
      9       0.6925      0.00000
     10       1.1951      0.00000
     11       0.1920      0.00000
     12       0.1976      0.00000
     13      -0.9161      0.00000
     14       1.2149      0.00000
     15      -0.2692      0.00000
     16       2.4607      0.00000
     17      -0.8355      0.00000
     18      -1.2624      0.00000
     19      -1.4252      0.00000
     20       0.6809      0.00000

 k-point 533 :       0.1250    0.3750    0.2083
  band No.  band energies     occupation 
      1       0.0021      0.00000
      2       2.2456      0.00000
      3      -2.5673      0.00000
      4       0.4117      0.00000
      5      -1.9016      0.00000
      6       1.1298      0.00000
      7      -0.0577      0.00000
      8       0.4064      0.00000
      9      -1.9518      0.00000
     10       2.6702      0.00000
     11      -0.5167      0.00000
     12      -0.4847      0.00000
     13       1.1517      0.00000
     14      -0.7626      0.00000
     15       2.0377      0.00000
     16      -0.7245      0.00000
     17       1.3020      0.00000
     18      -0.6683      0.00000
     19      -2.9165      0.00000
     20       0.4578      0.00000

 k-point 534 :       0.2083    0.1250    0.3750
  band No.  band energies     occupation 
      1       0.0043      0.00000
      2       2.9302      0.00000
      3      -3.4260      0.00000
      4       0.4727      0.00000
      5       0.3317      0.00000
      6      -1.5585      0.00000
      7       0.8813      0.00000
      8      -1.4003      0.00000
      9       1.3533      0.00000
     10       1.1685      0.00000
     11      -0.5585      0.00000
     12       1.0118      0.00000
     13      -1.2321      0.00000
     14       1.3661      0.00000
     15       1.0316      0.00000
     16       0.8454      0.00000
     17      -1.3408      0.00000
     18      -0.8240      0.00000
     19      -1.5124      0.00000
     20      -0.2808      0.00000

 k-point 535 :       0.0833    0.2500   -0.1250
  band No.  band energies     occupation 
      1       0.0464      0.00000
      2       6.1647      0.00000
      3       1.2061      0.00000
      4     -10.7380      0.00000
      5       6.7457      0.00000
      6      -4.1658      0.00000
      7      -6.8166      0.00000
      8       1.6440      0.00000
      9      -2.0685      0.00000
     10       5.5126      0.00000
     11       3.8698      0.00000
     12       2.0732      0.00000
     13       1.7989      0.00000
     14      -0.0469      0.00000
     15       6.5080      0.00000
     16       4.2437      0.00000
     17      -7.4163      0.00000
     18      -3.7157      0.00000
     19      -7.1163      0.00000
     20       1.3864      0.00000

 k-point 536 :       0.1667   -0.0833   -0.2083
  band No.  band energies     occupation 
      1      -0.0021      0.00000
      2      -2.2456      0.00000
      3       2.5673      0.00000
      4      -0.4117      0.00000
      5       1.9016      0.00000
      6      -1.1298      0.00000
      7       0.0577      0.00000
      8      -0.4064      0.00000
      9       1.9518      0.00000
     10      -2.6702      0.00000
     11       0.5167      0.00000
     12       0.4847      0.00000
     13      -1.1517      0.00000
     14       0.7626      0.00000
     15      -2.0377      0.00000
     16       0.7245      0.00000
     17      -1.3020      0.00000
     18       0.6683      0.00000
     19       2.9165      0.00000
     20      -0.4578      0.00000

 k-point 537 :      -0.2500   -0.1667   -0.3750
  band No.  band energies     occupation 
      1      -0.0043      0.00000
      2      -2.9302      0.00000
      3       3.4260      0.00000
      4      -0.4727      0.00000
      5      -0.3317      0.00000
      6       1.5585      0.00000
      7      -0.8813      0.00000
      8       1.4003      0.00000
      9      -1.3533      0.00000
     10      -1.1685      0.00000
     11       0.5585      0.00000
     12      -1.0118      0.00000
     13       1.2321      0.00000
     14      -1.3661      0.00000
     15      -1.0316      0.00000
     16      -0.8454      0.00000
     17       1.3408      0.00000
     18       0.8240      0.00000
     19       1.5124      0.00000
     20       0.2808      0.00000

 k-point 538 :       0.1250    0.4583    0.2083
  band No.  band energies     occupation 
      1      -0.0420      0.00000
      2       2.3352      0.00000
      3      -2.6025      0.00000
      4       0.3742      0.00000
      5      -8.9380      0.00000
      6       7.1904      0.00000
      7      -1.0330      0.00000
      8       1.5086      0.00000
      9      -4.2545      0.00000
     10       6.9020      0.00000
     11      -1.6730      0.00000
     12      -1.0788      0.00000
     13      -0.1163      0.00000
     14       4.9350      0.00000
     15       5.4652      0.00000
     16       1.0156      0.00000
     17      -4.8980      0.00000
     18      -2.5799      0.00000
     19      -8.6304      0.00000
     20       2.4645      0.00000

 k-point 539 :       0.2083    0.1250    0.4583
  band No.  band energies     occupation 
      1      -0.0437      0.00000
      2       2.9206      0.00000
      3      -4.5740      0.00000
      4       1.7985      0.00000
      5       6.3570      0.00000
      6     -10.6041      0.00000
      7       3.6672      0.00000
      8      -5.2903      0.00000
      9       4.6863      0.00000
     10       3.1929      0.00000
     11      -1.8286      0.00000
     12       1.1122      0.00000
     13       0.9397      0.00000
     14       2.8365      0.00000
     15       0.7347      0.00000
     16      -0.9615      0.00000
     17       0.3927      0.00000
     18      -4.0663      0.00000
     19      -2.3336      0.00000
     20      -2.3094      0.00000

 k-point 540 :       0.0833    0.3333   -0.1250
  band No.  band energies     occupation 
      1      -0.0402      0.00000
      2       3.6436      0.00000
      3       3.2181      0.00000
      4      -9.3024      0.00000
      5       3.4565      0.00000
      6      -2.5328      0.00000
      7      -4.1982      0.00000
      8      -1.2505      0.00000
      9       6.6709      0.00000
     10      -2.6546      0.00000
     11       1.7470      0.00000
     12       6.5068      0.00000
     13      -1.1285      0.00000
     14       6.1008      0.00000
     15      -3.5130      0.00000
     16       0.4049      0.00000
     17       6.0402      0.00000
     18      -2.6161      0.00000
     19     -12.4891      0.00000
     20      -5.6315      0.00000

 k-point 541 :       0.2500   -0.0833   -0.2083
  band No.  band energies     occupation 
      1       0.0420      0.00000
      2      -2.3352      0.00000
      3       2.6025      0.00000
      4      -0.3742      0.00000
      5       8.9380      0.00000
      6      -7.1904      0.00000
      7       1.0330      0.00000
      8      -1.5086      0.00000
      9       4.2545      0.00000
     10      -6.9020      0.00000
     11       1.6730      0.00000
     12       1.0788      0.00000
     13       0.1163      0.00000
     14      -4.9350      0.00000
     15      -5.4652      0.00000
     16      -1.0156      0.00000
     17       4.8980      0.00000
     18       2.5799      0.00000
     19       8.6304      0.00000
     20      -2.4645      0.00000

 k-point 542 :      -0.3333   -0.2500   -0.4583
  band No.  band energies     occupation 
      1       0.0437      0.00000
      2      -2.9206      0.00000
      3       4.5740      0.00000
      4      -1.7985      0.00000
      5      -6.3570      0.00000
      6      10.6041      0.00000
      7      -3.6672      0.00000
      8       5.2903      0.00000
      9      -4.6863      0.00000
     10      -3.1929      0.00000
     11       1.8286      0.00000
     12      -1.1122      0.00000
     13      -0.9397      0.00000
     14      -2.8365      0.00000
     15      -0.7347      0.00000
     16       0.9615      0.00000
     17      -0.3927      0.00000
     18       4.0663      0.00000
     19       2.3336      0.00000
     20       2.3094      0.00000

 k-point 543 :       0.1250   -0.4583    0.2083
  band No.  band energies     occupation 
      1      -0.4368      0.00000
      2       2.6605      0.00000
      3      -1.6258      0.00000
      4      -0.8429      0.00000
      5      -8.5297      0.00000
      6       6.6180      0.00000
      7      -1.4324      0.00000
      8      -0.6061      0.00000
      9       2.5504      0.00000
     10       2.6248      0.00000
     11      -0.2311      0.00000
     12      -2.7543      0.00000
     13       3.4228      0.00000
     14       5.1660      0.00000
     15       5.6594      0.00000
     16       0.6292      0.00000
     17      -7.3388      0.00000
     18      -6.0447      0.00000
     19      -8.8556      0.00000
     20       4.5602      0.00000

 k-point 544 :       0.2083    0.1250   -0.4583
  band No.  band energies     occupation 
      1      -0.4619      0.00000
      2       3.0041      0.00000
      3      -5.8121      0.00000
      4       3.4443      0.00000
      5      11.2436      0.00000
      6     -17.4829      0.00000
      7       3.6608      0.00000
      8      -7.7845      0.00000
      9       7.6711      0.00000
     10       4.1947      0.00000
     11      -0.2180      0.00000
     12       0.7420      0.00000
     13       2.2445      0.00000
     14       3.2502      0.00000
     15       0.5406      0.00000
     16      -1.3500      0.00000
     17      -1.7039      0.00000
     18       1.1503      0.00000
     19      -2.0324      0.00000
     20      -8.5405      0.00000

 k-point 545 :       0.0833   -0.5833   -0.1250
  band No.  band energies     occupation 
      1      -0.5213      0.00000
      2       3.1892      0.00000
      3       3.7725      0.00000
      4      -8.0599      0.00000
      5      -6.9203      0.00000
      6       7.1028      0.00000
      7      -1.8449      0.00000
      8      -5.3147      0.00000
      9       9.1014      0.00000
     10      -4.8039      0.00000
     11       0.3384      0.00000
     12       7.2017      0.00000
     13       1.6190      0.00000
     14      -1.4564      0.00000
     15       8.2295      0.00000
     16      -2.8151      0.00000
     17      12.8366      0.00000
     18      -0.2355      0.00000
     19     -10.2283      0.00000
     20     -13.5016      0.00000

 k-point 546 :      -0.6667   -0.0833   -0.2083
  band No.  band energies     occupation 
      1       0.4368      0.00000
      2      -2.6605      0.00000
      3       1.6258      0.00000
      4       0.8429      0.00000
      5       8.5297      0.00000
      6      -6.6180      0.00000
      7       1.4324      0.00000
      8       0.6061      0.00000
      9      -2.5504      0.00000
     10      -2.6248      0.00000
     11       0.2311      0.00000
     12       2.7543      0.00000
     13      -3.4228      0.00000
     14      -5.1660      0.00000
     15      -5.6594      0.00000
     16      -0.6292      0.00000
     17       7.3388      0.00000
     18       6.0447      0.00000
     19       8.8556      0.00000
     20      -4.5602      0.00000

 k-point 547 :       0.5833    0.6667    0.4583
  band No.  band energies     occupation 
      1       0.4619      0.00000
      2      -3.0041      0.00000
      3       5.8121      0.00000
      4      -3.4443      0.00000
      5     -11.2436      0.00000
      6      17.4829      0.00000
      7      -3.6608      0.00000
      8       7.7845      0.00000
      9      -7.6711      0.00000
     10      -4.1947      0.00000
     11       0.2180      0.00000
     12      -0.7420      0.00000
     13      -2.2445      0.00000
     14      -3.2502      0.00000
     15      -0.5406      0.00000
     16       1.3500      0.00000
     17       1.7039      0.00000
     18      -1.1503      0.00000
     19       2.0324      0.00000
     20       8.5405      0.00000

 k-point 548 :       0.1250   -0.3750    0.2083
  band No.  band energies     occupation 
      1      -1.6106      0.00000
      2       4.0060      0.00000
      3       0.8451      0.00000
      4      -4.0185      0.00000
      5      -3.0805      0.00000
      6       1.4617      0.00000
      7      -1.1223      0.00000
      8      -5.6554      0.00000
      9       8.9728      0.00000
     10      -4.8852      0.00000
     11       6.2578      0.00000
     12      -0.9416      0.00000
     13       5.3121      0.00000
     14       0.9420      0.00000
     15       5.2303      0.00000
     16      -3.1144      0.00000
     17       5.4320      0.00000
     18      -5.4062      0.00000
     19      -0.8882      0.00000
     20     -11.6079      0.00000

 k-point 549 :       0.2083    0.1250   -0.3750
  band No.  band energies     occupation 
      1      -1.5932      0.00000
      2       4.0779      0.00000
      3      -7.5811      0.00000
      4       5.2488      0.00000
      5       7.5404      0.00000
      6     -14.2125      0.00000
      7       3.1684      0.00000
      8      -8.2609      0.00000
      9       8.6466      0.00000
     10      -0.4740      0.00000
     11       8.8826      0.00000
     12      -2.3281      0.00000
     13       0.7874      0.00000
     14       4.7474      0.00000
     15      -1.2713      0.00000
     16       4.4406      0.00000
     17      -6.5109      0.00000
     18       8.1546      0.00000
     19      -8.6523      0.00000
     20     -12.3231      0.00000

 k-point 550 :       0.0833   -0.5000   -0.1250
  band No.  band energies     occupation 
      1      -1.5548      0.00000
      2       3.8095      0.00000
      3       2.9313      0.00000
      4      -6.0510      0.00000
      5      -8.9064      0.00000
      6       8.2895      0.00000
      7      -1.5179      0.00000
      8      -2.1262      0.00000
      9       4.5211      0.00000
     10      -3.1934      0.00000
     11       1.6188      0.00000
     12       1.7321      0.00000
     13       2.8862      0.00000
     14       3.4895      0.00000
     15       6.7136      0.00000
     16       3.9257      0.00000
     17       0.9235      0.00000
     18     -10.0036      0.00000
     19     -11.5492      0.00000
     20       0.8412      0.00000

 k-point 551 :      -0.5833   -0.0833   -0.2083
  band No.  band energies     occupation 
      1       1.6106      0.00000
      2      -4.0060      0.00000
      3      -0.8451      0.00000
      4       4.0185      0.00000
      5       3.0805      0.00000
      6      -1.4617      0.00000
      7       1.1223      0.00000
      8       5.6554      0.00000
      9      -8.9728      0.00000
     10       4.8852      0.00000
     11      -6.2578      0.00000
     12       0.9416      0.00000
     13      -5.3121      0.00000
     14      -0.9420      0.00000
     15      -5.2303      0.00000
     16       3.1144      0.00000
     17      -5.4320      0.00000
     18       5.4062      0.00000
     19       0.8882      0.00000
     20      11.6079      0.00000

 k-point 552 :       0.5000    0.5833    0.3750
  band No.  band energies     occupation 
      1       1.5932      0.00000
      2      -4.0779      0.00000
      3       7.5811      0.00000
      4      -5.2488      0.00000
      5      -7.5404      0.00000
      6      14.2125      0.00000
      7      -3.1684      0.00000
      8       8.2609      0.00000
      9      -8.6466      0.00000
     10       0.4740      0.00000
     11      -8.8826      0.00000
     12       2.3281      0.00000
     13      -0.7874      0.00000
     14      -4.7474      0.00000
     15       1.2713      0.00000
     16      -4.4406      0.00000
     17       6.5109      0.00000
     18      -8.1546      0.00000
     19       8.6523      0.00000
     20      12.3231      0.00000

 k-point 553 :       0.1250   -0.2917    0.2083
  band No.  band energies     occupation 
      1      -0.2632      0.00000
      2       3.1628      0.00000
      3       3.4200      0.00000
      4      -7.7744      0.00000
      5       1.0882      0.00000
      6      -2.6433      0.00000
      7      -0.5837      0.00000
      8      -4.3434      0.00000
      9       7.7343      0.00000
     10      -3.9629      0.00000
     11       2.4266      0.00000
     12       5.9768      0.00000
     13       1.0144      0.00000
     14      -1.3282      0.00000
     15       6.7288      0.00000
     16      -4.1249      0.00000
     17       8.0676      0.00000
     18       3.1692      0.00000
     19     -13.8986      0.00000
     20      -8.7592      0.00000

 k-point 554 :       0.2083    0.1250   -0.2917
  band No.  band energies     occupation 
      1      -0.2389      0.00000
      2       2.9694      0.00000
      3      -7.1436      0.00000
      4       4.4515      0.00000
      5       4.2705      0.00000
      6     -10.1863      0.00000
      7       3.9623      0.00000
      8      -5.9581      0.00000
      9       5.2998      0.00000
     10       2.0889      0.00000
     11       2.5856      0.00000
     12       0.7366      0.00000
     13       2.7777      0.00000
     14       0.7431      0.00000
     15       0.7164      0.00000
     16      -1.6558      0.00000
     17       2.2361      0.00000
     18      -4.2530      0.00000
     19      -2.7298      0.00000
     20      -5.0119      0.00000

 k-point 555 :       0.0833   -0.4167   -0.1250
  band No.  band energies     occupation 
      1      -0.2162      0.00000
      2       2.3508      0.00000
      3      -0.2798      0.00000
      4      -2.1297      0.00000
      5      -8.0875      0.00000
      6       6.8551      0.00000
      7      -1.9965      0.00000
      8       2.7771      0.00000
      9      -2.4896      0.00000
     10       2.9655      0.00000
     11       0.2874      0.00000
     12      -2.0126      0.00000
     13       1.3640      0.00000
     14       6.4229      0.00000
     15       6.5135      0.00000
     16       3.3094      0.00000
     17      -9.3617      0.00000
     18      -2.6991      0.00000
     19     -10.4971      0.00000
     20       0.4978      0.00000

 k-point 556 :      -0.5000   -0.0833   -0.2083
  band No.  band energies     occupation 
      1       0.2632      0.00000
      2      -3.1628      0.00000
      3      -3.4200      0.00000
      4       7.7744      0.00000
      5      -1.0882      0.00000
      6       2.6433      0.00000
      7       0.5837      0.00000
      8       4.3434      0.00000
      9      -7.7343      0.00000
     10       3.9629      0.00000
     11      -2.4266      0.00000
     12      -5.9768      0.00000
     13      -1.0144      0.00000
     14       1.3282      0.00000
     15      -6.7288      0.00000
     16       4.1249      0.00000
     17      -8.0676      0.00000
     18      -3.1692      0.00000
     19      13.8986      0.00000
     20       8.7592      0.00000

 k-point 557 :       0.4167    0.5000    0.2917
  band No.  band energies     occupation 
      1       0.2389      0.00000
      2      -2.9694      0.00000
      3       7.1436      0.00000
      4      -4.4515      0.00000
      5      -4.2705      0.00000
      6      10.1863      0.00000
      7      -3.9623      0.00000
      8       5.9581      0.00000
      9      -5.2998      0.00000
     10      -2.0889      0.00000
     11      -2.5856      0.00000
     12      -0.7366      0.00000
     13      -2.7777      0.00000
     14      -0.7431      0.00000
     15      -0.7164      0.00000
     16       1.6558      0.00000
     17      -2.2361      0.00000
     18       4.2530      0.00000
     19       2.7298      0.00000
     20       5.0119      0.00000

 k-point 558 :       0.1250   -0.2083    0.2083
  band No.  band energies     occupation 
      1       0.0034      0.00000
      2       3.9869      0.00000
      3       3.3300      0.00000
      4      -9.5358      0.00000
      5       3.9118      0.00000
      6      -5.7876      0.00000
      7      -1.5281      0.00000
      8      -0.6747      0.00000
      9       4.1321      0.00000
     10      -1.0153      0.00000
     11       4.4417      0.00000
     12       3.4809      0.00000
     13      -0.9954      0.00000
     14       4.1336      0.00000
     15       1.4997      0.00000
     16      -4.1805      0.00000
     17       3.9881      0.00000
     18      -2.1990      0.00000
     19      -9.7713      0.00000
     20      -2.8220      0.00000

 k-point 559 :       0.2083    0.1250   -0.2083
  band No.  band energies     occupation 
      1      -0.0116      0.00000
      2       3.2883      0.00000
      3      -5.3389      0.00000
      4       1.9217      0.00000
      5       1.4939      0.00000
      6      -5.1069      0.00000
      7       5.1621      0.00000
      8      -6.1074      0.00000
      9       2.6984      0.00000
     10       2.4335      0.00000
     11       0.6380      0.00000
     12       1.0353      0.00000
     13       0.0528      0.00000
     14       1.8927      0.00000
     15       0.4130      0.00000
     16      -0.2023      0.00000
     17       0.5782      0.00000
     18      -2.7563      0.00000
     19      -3.7450      0.00000
     20      -1.2773      0.00000

 k-point 560 :       0.0833   -0.3333   -0.1250
  band No.  band energies     occupation 
      1      -0.0148      0.00000
      2       2.2625      0.00000
      3      -2.4749      0.00000
      4       0.2988      0.00000
      5      -4.9686      0.00000
      6       3.7470      0.00000
      7      -1.8791      0.00000
      8       3.0436      0.00000
      9      -9.5816      0.00000
     10       9.7054      0.00000
     11      -0.6302      0.00000
     12      -0.4227      0.00000
     13      -2.0190      0.00000
     14       5.0049      0.00000
     15       4.4014      0.00000
     16       5.3562      0.00000
     17      -6.1376      0.00000
     18      -2.3968      0.00000
     19      -7.2283      0.00000
     20       3.0522      0.00000

 k-point 561 :      -0.4167   -0.0833   -0.2083
  band No.  band energies     occupation 
      1      -0.0034      0.00000
      2      -3.9869      0.00000
      3      -3.3300      0.00000
      4       9.5358      0.00000
      5      -3.9118      0.00000
      6       5.7876      0.00000
      7       1.5281      0.00000
      8       0.6747      0.00000
      9      -4.1321      0.00000
     10       1.0153      0.00000
     11      -4.4417      0.00000
     12      -3.4809      0.00000
     13       0.9954      0.00000
     14      -4.1336      0.00000
     15      -1.4997      0.00000
     16       4.1805      0.00000
     17      -3.9881      0.00000
     18       2.1990      0.00000
     19       9.7713      0.00000
     20       2.8220      0.00000

 k-point 562 :       0.3333    0.4167    0.2083
  band No.  band energies     occupation 
      1       0.0116      0.00000
      2      -3.2883      0.00000
      3       5.3389      0.00000
      4      -1.9217      0.00000
      5      -1.4939      0.00000
      6       5.1069      0.00000
      7      -5.1621      0.00000
      8       6.1074      0.00000
      9      -2.6984      0.00000
     10      -2.4335      0.00000
     11      -0.6380      0.00000
     12      -1.0353      0.00000
     13      -0.0528      0.00000
     14      -1.8927      0.00000
     15      -0.4130      0.00000
     16       0.2023      0.00000
     17      -0.5782      0.00000
     18       2.7563      0.00000
     19       3.7450      0.00000
     20       1.2773      0.00000

 k-point 563 :       0.1250   -0.1250    0.2083
  band No.  band energies     occupation 
      1       0.0427      0.00000
      2       6.7771      0.00000
      3       1.2774      0.00000
      4     -10.9149      0.00000
      5       4.3156      0.00000
      6      -3.8588      0.00000
      7      -4.2717      0.00000
      8       1.7017      0.00000
      9      -1.4559      0.00000
     10       4.2050      0.00000
     11       5.6618      0.00000
     12      -0.9587      0.00000
     13      -0.6421      0.00000
     14       3.1238      0.00000
     15       3.1520      0.00000
     16       4.0875      0.00000
     17      -6.5607      0.00000
     18      -2.2205      0.00000
     19      -6.0928      0.00000
     20       2.8891      0.00000

 k-point 564 :       0.2083    0.1250   -0.1250
  band No.  band energies     occupation 
      1       0.0076      0.00000
      2       3.4124      0.00000
      3      -3.7951      0.00000
      4       0.1593      0.00000
      5       0.3272      0.00000
      6      -1.0741      0.00000
      7       0.5244      0.00000
      8      -1.0297      0.00000
      9       0.3804      0.00000
     10       1.1926      0.00000
     11       0.5842      0.00000
     12       0.8193      0.00000
     13      -1.8191      0.00000
     14       6.4688      0.00000
     15      -3.7491      0.00000
     16       0.3485      0.00000
     17      -1.0591      0.00000
     18      -0.6887      0.00000
     19      -1.5132      0.00000
     20       0.7296      0.00000

 k-point 565 :       0.0833   -0.2500   -0.1250
  band No.  band energies     occupation 
      1       0.0031      0.00000
      2       2.3152      0.00000
      3      -2.8521      0.00000
      4       0.6303      0.00000
      5      -1.2506      0.00000
      6       0.5619      0.00000
      7       0.0287      0.00000
      8       0.5051      0.00000
      9      -1.1494      0.00000
     10       1.1772      0.00000
     11      -0.0230      0.00000
     12      -1.1279      0.00000
     13       2.1722      0.00000
     14       4.2680      0.00000
     15      -7.1702      0.00000
     16       2.1492      0.00000
     17       2.0938      0.00000
     18      -0.8135      0.00000
     19      -2.3620      0.00000
     20       1.5470      0.00000

 k-point 566 :      -0.3333   -0.0833   -0.2083
  band No.  band energies     occupation 
      1      -0.0427      0.00000
      2      -6.7771      0.00000
      3      -1.2774      0.00000
      4      10.9149      0.00000
      5      -4.3156      0.00000
      6       3.8588      0.00000
      7       4.2717      0.00000
      8      -1.7017      0.00000
      9       1.4559      0.00000
     10      -4.2050      0.00000
     11      -5.6618      0.00000
     12       0.9587      0.00000
     13       0.6421      0.00000
     14      -3.1238      0.00000
     15      -3.1520      0.00000
     16      -4.0875      0.00000
     17       6.5607      0.00000
     18       2.2205      0.00000
     19       6.0928      0.00000
     20      -2.8891      0.00000

 k-point 567 :       0.2500    0.3333    0.1250
  band No.  band energies     occupation 
      1      -0.0076      0.00000
      2      -3.4124      0.00000
      3       3.7951      0.00000
      4      -0.1593      0.00000
      5      -0.3272      0.00000
      6       1.0741      0.00000
      7      -0.5244      0.00000
      8       1.0297      0.00000
      9      -0.3804      0.00000
     10      -1.1926      0.00000
     11      -0.5842      0.00000
     12      -0.8193      0.00000
     13       1.8191      0.00000
     14      -6.4688      0.00000
     15       3.7491      0.00000
     16      -0.3485      0.00000
     17       1.0591      0.00000
     18       0.6887      0.00000
     19       1.5132      0.00000
     20      -0.7296      0.00000

 k-point 568 :       0.1250    0.2917    0.2917
  band No.  band energies     occupation 
      1      -0.0064      0.00000
      2      -2.7861      0.00000
      3       7.1315      0.00000
      4      -4.5458      0.00000
      5       2.1950      0.00000
      6       6.3533      0.00000
      7      -7.4667      0.00000
      8      -0.8623      0.00000
      9       1.7831      0.00000
     10      -1.5147      0.00000
     11      -0.7832      0.00000
     12       1.7004      0.00000
     13      -5.5142      0.00000
     14       3.5300      0.00000
     15       5.5340      0.00000
     16      -5.3104      0.00000
     17      -4.1399      0.00000
     18       1.6906      0.00000
     19       4.5169      0.00000
     20      -5.4536      0.00000

 k-point 569 :       0.1667    0.1667   -0.1250
  band No.  band energies     occupation 
      1       0.0265      0.00000
      2       4.8012      0.00000
      3       0.8464      0.00000
      4      -7.0826      0.00000
      5       1.8852      0.00000
      6      -0.1320      0.00000
      7      -3.9318      0.00000
      8      -0.0077      0.00000
      9      -0.3263      0.00000
     10       2.8611      0.00000
     11       7.6281      0.00000
     12      -4.5858      0.00000
     13      -4.3907      0.00000
     14       6.0068      0.00000
     15       2.3684      0.00000
     16       1.9920      0.00000
     17      -4.0263      0.00000
     18      -1.5584      0.00000
     19      -4.2543      0.00000
     20       2.5425      0.00000

 k-point 570 :       0.0000   -0.1667   -0.2917
  band No.  band energies     occupation 
      1       0.0064      0.00000
      2       2.7861      0.00000
      3      -7.1315      0.00000
      4       4.5458      0.00000
      5      -2.1950      0.00000
      6      -6.3533      0.00000
      7       7.4667      0.00000
      8       0.8623      0.00000
      9      -1.7831      0.00000
     10       1.5147      0.00000
     11       0.7832      0.00000
     12      -1.7004      0.00000
     13       5.5142      0.00000
     14      -3.5300      0.00000
     15      -5.5340      0.00000
     16       5.3104      0.00000
     17       4.1399      0.00000
     18      -1.6906      0.00000
     19      -4.5169      0.00000
     20       5.4536      0.00000

 k-point 571 :       0.1250    0.3750    0.2917
  band No.  band energies     occupation 
      1       0.0001      0.00000
      2      -1.7005      0.00000
      3       1.8250      0.00000
      4      -0.1644      0.00000
      5       1.3175      0.00000
      6      -1.3485      0.00000
      7       0.1590      0.00000
      8      -0.2839      0.00000
      9       3.5203      0.00000
     10      -3.2202      0.00000
     11       0.0832      0.00000
     12       1.1004      0.00000
     13      -1.7525      0.00000
     14       1.6211      0.00000
     15      -4.6041      0.00000
     16       3.1460      0.00000
     17      -1.6993      0.00000
     18       0.7751      0.00000
     19       2.0361      0.00000
     20      -2.9685      0.00000

 k-point 572 :       0.2917    0.1250    0.3750
  band No.  band energies     occupation 
      1      -0.0034      0.00000
      2      -3.3426      0.00000
      3       4.0987      0.00000
      4      -0.5822      0.00000
      5      -0.4002      0.00000
      6       1.2453      0.00000
      7      -0.3144      0.00000
      8       0.6914      0.00000
      9       0.3026      0.00000
     10      -1.4576      0.00000
     11      -1.0712      0.00000
     12      -1.2249      0.00000
     13       2.4436      0.00000
     14      -2.1146      0.00000
     15      -0.8984      0.00000
     16       0.5792      0.00000
     17       0.6376      0.00000
     18       0.6490      0.00000
     19       1.5026      0.00000
     20      -0.3683      0.00000

 k-point 573 :       0.1667    0.2500   -0.1250
  band No.  band energies     occupation 
      1       0.0272      0.00000
      2       6.7334      0.00000
      3       0.9306      0.00000
      4      -9.8398      0.00000
      5       3.4759      0.00000
      6     -10.8221      0.00000
      7       8.3148      0.00000
      8      -3.6206      0.00000
      9      -2.5999      0.00000
     10       4.8186      0.00000
     11       6.5138      0.00000
     12      -0.2709      0.00000
     13      -0.5828      0.00000
     14      -0.3602      0.00000
     15       4.9454      0.00000
     16       2.8691      0.00000
     17      -4.9052      0.00000
     18      -1.1465      0.00000
     19      -7.9361      0.00000
     20       1.0147      0.00000

 k-point 574 :       0.0833   -0.1667   -0.2917
  band No.  band energies     occupation 
      1      -0.0001      0.00000
      2       1.7005      0.00000
      3      -1.8250      0.00000
      4       0.1644      0.00000
      5      -1.3175      0.00000
      6       1.3485      0.00000
      7      -0.1590      0.00000
      8       0.2839      0.00000
      9      -3.5203      0.00000
     10       3.2202      0.00000
     11      -0.0832      0.00000
     12      -1.1004      0.00000
     13       1.7525      0.00000
     14      -1.6211      0.00000
     15       4.6041      0.00000
     16      -3.1460      0.00000
     17       1.6993      0.00000
     18      -0.7751      0.00000
     19      -2.0361      0.00000
     20       2.9685      0.00000

 k-point 575 :      -0.2500   -0.0833   -0.3750
  band No.  band energies     occupation 
      1       0.0034      0.00000
      2       3.3426      0.00000
      3      -4.0987      0.00000
      4       0.5822      0.00000
      5       0.4002      0.00000
      6      -1.2453      0.00000
      7       0.3144      0.00000
      8      -0.6914      0.00000
      9      -0.3026      0.00000
     10       1.4576      0.00000
     11       1.0712      0.00000
     12       1.2249      0.00000
     13      -2.4436      0.00000
     14       2.1146      0.00000
     15       0.8984      0.00000
     16      -0.5792      0.00000
     17      -0.6376      0.00000
     18      -0.6490      0.00000
     19      -1.5026      0.00000
     20       0.3683      0.00000

 k-point 576 :       0.1250    0.4583    0.2917
  band No.  band energies     occupation 
      1      -0.0136      0.00000
      2       1.3474      0.00000
      3      -0.9658      0.00000
      4      -0.4024      0.00000
      5      -2.1988      0.00000
      6       2.4394      0.00000
      7      -0.3162      0.00000
      8       0.5451      0.00000
      9      -5.6749      0.00000
     10       5.2462      0.00000
     11      -0.1515      0.00000
     12      -2.2587      0.00000
     13       1.9865      0.00000
     14       2.9075      0.00000
     15      -0.4645      0.00000
     16       1.7048      0.00000
     17      -1.8175      0.00000
     18      -2.0110      0.00000
     19      -1.1784      0.00000
     20      -1.5328      0.00000

 k-point 577 :       0.2917    0.1250    0.4583
  band No.  band energies     occupation 
      1      -0.0155      0.00000
      2       2.9087      0.00000
      3      -3.9679      0.00000
      4       1.0524      0.00000
      5       0.8064      0.00000
      6      -2.3752      0.00000
      7       0.9470      0.00000
      8      -0.8079      0.00000
      9      -0.3268      0.00000
     10       1.5789      0.00000
     11       0.7823      0.00000
     12       1.1159      0.00000
     13      -1.2088      0.00000
     14       4.3769      0.00000
     15      -4.3619      0.00000
     16       0.1496      0.00000
     17       0.7611      0.00000
     18      -1.2351      0.00000
     19      -1.3895      0.00000
     20       0.1927      0.00000

 k-point 578 :       0.1667    0.3333   -0.1250
  band No.  band energies     occupation 
      1      -0.0403      0.00000
      2       6.0347      0.00000
      3       0.7292      0.00000
      4      -8.5997      0.00000
      5       4.1198      0.00000
      6     -10.9186      0.00000
      7       7.7692      0.00000
      8      -4.9180      0.00000
      9       6.7823      0.00000
     10      -4.2603      0.00000
     11       5.2593      0.00000
     12       3.1878      0.00000
     13      -0.3657      0.00000
     14       2.5866      0.00000
     15       1.4734      0.00000
     16      -4.6129      0.00000
     17       4.3084      0.00000
     18     -12.0043      0.00000
     19       3.2573      0.00000
     20      -7.3353      0.00000

 k-point 579 :       0.1667   -0.1667   -0.2917
  band No.  band energies     occupation 
      1       0.0136      0.00000
      2      -1.3474      0.00000
      3       0.9658      0.00000
      4       0.4024      0.00000
      5       2.1988      0.00000
      6      -2.4395      0.00000
      7       0.3162      0.00000
      8      -0.5451      0.00000
      9       5.6749      0.00000
     10      -5.2462      0.00000
     11       0.1515      0.00000
     12       2.2587      0.00000
     13      -1.9865      0.00000
     14      -2.9075      0.00000
     15       0.4645      0.00000
     16      -1.7048      0.00000
     17       1.8175      0.00000
     18       2.0110      0.00000
     19       1.1784      0.00000
     20       1.5328      0.00000

 k-point 580 :      -0.3333   -0.1667   -0.4583
  band No.  band energies     occupation 
      1       0.0155      0.00000
      2      -2.9087      0.00000
      3       3.9679      0.00000
      4      -1.0525      0.00000
      5      -0.8064      0.00000
      6       2.3752      0.00000
      7      -0.9470      0.00000
      8       0.8079      0.00000
      9       0.3268      0.00000
     10      -1.5789      0.00000
     11      -0.7823      0.00000
     12      -1.1159      0.00000
     13       1.2088      0.00000
     14      -4.3769      0.00000
     15       4.3619      0.00000
     16      -0.1496      0.00000
     17      -0.7611      0.00000
     18       1.2351      0.00000
     19       1.3895      0.00000
     20      -0.1927      0.00000

 k-point 581 :       0.1250   -0.4583    0.2917
  band No.  band energies     occupation 
      1      -0.2126      0.00000
      2       2.0891      0.00000
      3       0.3523      0.00000
      4      -2.5512      0.00000
      5      -6.9196      0.00000
      6       7.4705      0.00000
      7      -1.4097      0.00000
      8       2.7442      0.00000
      9      -4.3445      0.00000
     10       2.6030      0.00000
     11       0.4250      0.00000
     12      -3.9682      0.00000
     13       3.3720      0.00000
     14       7.0430      0.00000
     15       0.1339      0.00000
     16       2.3137      0.00000
     17      -1.9081      0.00000
     18      -8.9360      0.00000
     19      -0.7053      0.00000
     20       2.3444      0.00000

 k-point 582 :       0.2917    0.1250   -0.4583
  band No.  band energies     occupation 
      1      -0.2456      0.00000
      2       3.4130      0.00000
      3      -6.6053      0.00000
      4       3.4959      0.00000
      5       4.2539      0.00000
      6     -10.4902      0.00000
      7       4.6870      0.00000
      8      -2.2665      0.00000
      9       0.3541      0.00000
     10       2.1709      0.00000
     11       3.6042      0.00000
     12       0.4054      0.00000
     13       1.5619      0.00000
     14      -0.5881      0.00000
     15      -0.6384      0.00000
     16      -1.0773      0.00000
     17       1.1441      0.00000
     18       0.9011      0.00000
     19      -2.5706      0.00000
     20      -5.5376      0.00000

 k-point 583 :       0.1667   -0.5833   -0.1250
  band No.  band energies     occupation 
      1      -0.3680      0.00000
      2       3.9357      0.00000
      3       2.0713      0.00000
      4      -6.9331      0.00000
      5       1.3068      0.00000
      6      -5.7564      0.00000
      7       5.7405      0.00000
      8      -7.1066      0.00000
      9       8.5789      0.00000
     10      -5.6546      0.00000
     11       5.3823      0.00000
     12       0.4961      0.00000
     13       1.3513      0.00000
     14       6.5541      0.00000
     15       0.2394      0.00000
     16      -3.3258      0.00000
     17       7.3477      0.00000
     18     -14.0862      0.00000
     19       7.5623      0.00000
     20      -9.0353      0.00000

 k-point 584 :      -0.7500   -0.1667   -0.2917
  band No.  band energies     occupation 
      1       0.2126      0.00000
      2      -2.0891      0.00000
      3      -0.3523      0.00000
      4       2.5512      0.00000
      5       6.9196      0.00000
      6      -7.4705      0.00000
      7       1.4097      0.00000
      8      -2.7442      0.00000
      9       4.3445      0.00000
     10      -2.6030      0.00000
     11      -0.4250      0.00000
     12       3.9682      0.00000
     13      -3.3720      0.00000
     14      -7.0430      0.00000
     15      -0.1339      0.00000
     16      -2.3137      0.00000
     17       1.9081      0.00000
     18       8.9360      0.00000
     19       0.7053      0.00000
     20      -2.3444      0.00000

 k-point 585 :       0.5833    0.7500    0.4583
  band No.  band energies     occupation 
      1       0.2456      0.00000
      2      -3.4130      0.00000
      3       6.6053      0.00000
      4      -3.4959      0.00000
      5      -4.2539      0.00000
      6      10.4902      0.00000
      7      -4.6870      0.00000
      8       2.2665      0.00000
      9      -0.3541      0.00000
     10      -2.1709      0.00000
     11      -3.6042      0.00000
     12      -0.4054      0.00000
     13      -1.5619      0.00000
     14       0.5881      0.00000
     15       0.6383      0.00000
     16       1.0773      0.00000
     17      -1.1441      0.00000
     18      -0.9011      0.00000
     19       2.5706      0.00000
     20       5.5376      0.00000

 k-point 586 :       0.1250   -0.3750    0.2917
  band No.  band energies     occupation 
      1      -1.6451      0.00000
      2       3.9492      0.00000
      3       2.4334      0.00000
      4      -5.5342      0.00000
      5      -8.2685      0.00000
      6       8.0018      0.00000
      7      -3.2419      0.00000
      8       3.5941      0.00000
      9       0.4923      0.00000
     10      -2.8640      0.00000
     11       3.0110      0.00000
     12      -2.2378      0.00000
     13       4.3488      0.00000
     14       3.7892      0.00000
     15       4.6631      0.00000
     16       2.3172      0.00000
     17      -2.4270      0.00000
     18       1.5913      0.00000
     19      -8.3276      0.00000
     20      -0.8789      0.00000

 k-point 587 :       0.2917    0.1250   -0.3750
  band No.  band energies     occupation 
      1      -1.6419      0.00000
      2       4.5379      0.00000
      3      -6.9989      0.00000
      4       4.2228      0.00000
      5       7.2907      0.00000
      6     -14.0808      0.00000
      7       9.6463      0.00000
      8      -7.7031      0.00000
      9       0.5354      0.00000
     10       1.7796      0.00000
     11       6.6330      0.00000
     12      -0.9678      0.00000
     13       0.1137      0.00000
     14      -2.8503      0.00000
     15       4.4947      0.00000
     16       4.0860      0.00000
     17     -10.4861      0.00000
     18       5.3576      0.00000
     19      -0.2187      0.00000
     20      -6.4130      0.00000

 k-point 588 :       0.1667   -0.5000   -0.1250
  band No.  band energies     occupation 
      1      -1.7535      0.00000
      2       4.3666      0.00000
      3       0.6283      0.00000
      4      -3.9800      0.00000
      5      -2.9803      0.00000
      6       1.3193      0.00000
      7       5.4773      0.00000
      8      -9.9621      0.00000
      9       7.4874      0.00000
     10      -4.5737      0.00000
     11       5.9396      0.00000
     12      -3.5967      0.00000
     13       5.7225      0.00000
     14       5.8070      0.00000
     15      -0.0192      0.00000
     16       0.4872      0.00000
     17       0.3877      0.00000
     18     -15.1961      0.00000
     19      14.7573      0.00000
     20      -7.6928      0.00000

 k-point 589 :      -0.6667   -0.1667   -0.2917
  band No.  band energies     occupation 
      1       1.6451      0.00000
      2      -3.9492      0.00000
      3      -2.4334      0.00000
      4       5.5342      0.00000
      5       8.2685      0.00000
      6      -8.0018      0.00000
      7       3.2419      0.00000
      8      -3.5941      0.00000
      9      -0.4923      0.00000
     10       2.8640      0.00000
     11      -3.0110      0.00000
     12       2.2378      0.00000
     13      -4.3488      0.00000
     14      -3.7892      0.00000
     15      -4.6631      0.00000
     16      -2.3172      0.00000
     17       2.4270      0.00000
     18      -1.5913      0.00000
     19       8.3276      0.00000
     20       0.8789      0.00000

 k-point 590 :       0.5000    0.6667    0.3750
  band No.  band energies     occupation 
      1       1.6419      0.00000
      2      -4.5379      0.00000
      3       6.9989      0.00000
      4      -4.2228      0.00000
      5      -7.2907      0.00000
      6      14.0808      0.00000
      7      -9.6463      0.00000
      8       7.7031      0.00000
      9      -0.5354      0.00000
     10      -1.7796      0.00000
     11      -6.6330      0.00000
     12       0.9678      0.00000
     13      -0.1137      0.00000
     14       2.8503      0.00000
     15      -4.4947      0.00000
     16      -4.0860      0.00000
     17      10.4861      0.00000
     18      -5.3576      0.00000
     19       0.2187      0.00000
     20       6.4130      0.00000

 k-point 591 :       0.1250   -0.2917    0.2917
  band No.  band energies     occupation 
      1      -0.6731      0.00000
      2       3.7843      0.00000
      3       2.6677      0.00000
      4      -7.1735      0.00000
      5      -7.1431      0.00000
      6       6.1931      0.00000
      7       4.9441      0.00000
      8     -10.2931      0.00000
      9       9.3052      0.00000
     10      -6.3298      0.00000
     11       3.6755      0.00000
     12       1.4075      0.00000
     13       1.7526      0.00000
     14       6.5552      0.00000
     15       1.2707      0.00000
     16      -0.6305      0.00000
     17       6.1425      0.00000
     18       7.1419      0.00000
     19     -13.1587      0.00000
     20      -6.2293      0.00000

 k-point 592 :       0.2917    0.1250   -0.2917
  band No.  band energies     occupation 
      1      -0.4539      0.00000
      2       3.3757      0.00000
      3      -5.4030      0.00000
      4       2.5911      0.00000
      5      10.5938      0.00000
      6     -16.2593      0.00000
      7       7.5575      0.00000
      8      -6.7824      0.00000
      9       1.4246      0.00000
     10       2.9225      0.00000
     11       2.1994      0.00000
     12       0.7432      0.00000
     13       0.0153      0.00000
     14      -0.3705      0.00000
     15       3.6680      0.00000
     16      -2.6067      0.00000
     17      -2.2289      0.00000
     18       2.5129      0.00000
     19      -1.8018      0.00000
     20      -4.5773      0.00000

 k-point 593 :       0.1667   -0.4167   -0.1250
  band No.  band energies     occupation 
      1      -0.4194      0.00000
      2       2.5668      0.00000
      3      -1.0798      0.00000
      4      -1.3681      0.00000
      5      -7.3494      0.00000
      6       6.5624      0.00000
      7      -2.9711      0.00000
      8       3.7411      0.00000
      9      -0.7440      0.00000
     10       0.7317      0.00000
     11       1.0786      0.00000
     12      -4.1047      0.00000
     13       4.5105      0.00000
     14       7.3000      0.00000
     15       0.9440      0.00000
     16      -1.7537      0.00000
     17       2.4822      0.00000
     18     -15.1762      0.00000
     19       4.2524      0.00000
     20       1.7619      0.00000

 k-point 594 :      -0.5833   -0.1667   -0.2917
  band No.  band energies     occupation 
      1       0.6731      0.00000
      2      -3.7843      0.00000
      3      -2.6677      0.00000
      4       7.1735      0.00000
      5       7.1431      0.00000
      6      -6.1931      0.00000
      7      -4.9441      0.00000
      8      10.2931      0.00000
      9      -9.3052      0.00000
     10       6.3298      0.00000
     11      -3.6755      0.00000
     12      -1.4075      0.00000
     13      -1.7526      0.00000
     14      -6.5552      0.00000
     15      -1.2707      0.00000
     16       0.6305      0.00000
     17      -6.1425      0.00000
     18      -7.1419      0.00000
     19      13.1587      0.00000
     20       6.2293      0.00000

 k-point 595 :       0.4167    0.5833    0.2917
  band No.  band energies     occupation 
      1       0.4539      0.00000
      2      -3.3757      0.00000
      3       5.4030      0.00000
      4      -2.5911      0.00000
      5     -10.5938      0.00000
      6      16.2593      0.00000
      7      -7.5575      0.00000
      8       6.7824      0.00000
      9      -1.4246      0.00000
     10      -2.9225      0.00000
     11      -2.1994      0.00000
     12      -0.7432      0.00000
     13      -0.0153      0.00000
     14       0.3705      0.00000
     15      -3.6680      0.00000
     16       2.6067      0.00000
     17       2.2289      0.00000
     18      -2.5129      0.00000
     19       1.8018      0.00000
     20       4.5773      0.00000

 k-point 596 :       0.1250   -0.2083    0.2917
  band No.  band energies     occupation 
      1      -0.1101      0.00000
      2       5.3760      0.00000
      3       1.0166      0.00000
      4      -8.3317      0.00000
      5       4.7780      0.00000
      6      -7.4550      0.00000
      7       5.2758      0.00000
      8      -7.1890      0.00000
      9       8.5420      0.00000
     10      -5.2475      0.00000
     11       3.0561      0.00000
     12       3.5212      0.00000
     13       2.6977      0.00000
     14       2.3439      0.00000
     15       3.1883      0.00000
     16      -4.9587      0.00000
     17       6.4410      0.00000
     18     -15.0230      0.00000
     19       3.6935      0.00000
     20      -8.6532      0.00000

 k-point 597 :       0.2917    0.1250   -0.2083
  band No.  band energies     occupation 
      1      -0.0330      0.00000
      2       2.6824      0.00000
      3      -3.4217      0.00000
      4       0.8079      0.00000
      5       4.2933      0.00000
      6      -6.3786      0.00000
      7       2.5852      0.00000
      8      -2.3420      0.00000
      9       0.5845      0.00000
     10       1.4618      0.00000
     11       0.0624      0.00000
     12       0.8778      0.00000
     13      -0.8409      0.00000
     14       4.6824      0.00000
     15      -4.6206      0.00000
     16       0.6712      0.00000
     17       0.5308      0.00000
     18      -0.6461      0.00000
     19      -2.6421      0.00000
     20      -0.4228      0.00000

 k-point 598 :       0.1667   -0.3333   -0.1250
  band No.  band energies     occupation 
      1      -0.0293      0.00000
      2       1.6342      0.00000
      3      -1.4569      0.00000
      4      -0.1833      0.00000
      5      -4.8969      0.00000
      6       4.6701      0.00000
      7      -0.7518      0.00000
      8       1.2062      0.00000
      9      -2.2498      0.00000
     10       2.2948      0.00000
     11      -0.2426      0.00000
     12      -2.3821      0.00000
     13       2.3647      0.00000
     14       4.3034      0.00000
     15      -2.8934      0.00000
     16       2.0426      0.00000
     17      -1.6429      0.00000
     18      -2.4300      0.00000
     19      -0.3865      0.00000
     20      -2.9253      0.00000

 k-point 599 :      -0.5000   -0.1667   -0.2917
  band No.  band energies     occupation 
      1       0.1101      0.00000
      2      -5.3760      0.00000
      3      -1.0166      0.00000
      4       8.3317      0.00000
      5      -4.7780      0.00000
      6       7.4550      0.00000
      7      -5.2758      0.00000
      8       7.1890      0.00000
      9      -8.5420      0.00000
     10       5.2475      0.00000
     11      -3.0561      0.00000
     12      -3.5212      0.00000
     13      -2.6977      0.00000
     14      -2.3439      0.00000
     15      -3.1883      0.00000
     16       4.9587      0.00000
     17      -6.4410      0.00000
     18      15.0230      0.00000
     19      -3.6935      0.00000
     20       8.6532      0.00000

 k-point 600 :       0.3333    0.5000    0.2083
  band No.  band energies     occupation 
      1       0.0330      0.00000
      2      -2.6824      0.00000
      3       3.4217      0.00000
      4      -0.8079      0.00000
      5      -4.2933      0.00000
      6       6.3786      0.00000
      7      -2.5852      0.00000
      8       2.3420      0.00000
      9      -0.5845      0.00000
     10      -1.4618      0.00000
     11      -0.0624      0.00000
     12      -0.8778      0.00000
     13       0.8409      0.00000
     14      -4.6824      0.00000
     15       4.6206      0.00000
     16      -0.6712      0.00000
     17      -0.5308      0.00000
     18       0.6461      0.00000
     19       2.6421      0.00000
     20       0.4228      0.00000

 k-point 601 :       0.1250   -0.1250    0.2917
  band No.  band energies     occupation 
      1       0.0183      0.00000
      2       6.0347      0.00000
      3       1.0204      0.00000
      4      -9.6382      0.00000
      5       5.0556      0.00000
      6      -8.0187      0.00000
      7       5.3979      0.00000
      8      -5.7102      0.00000
      9       1.1988      0.00000
     10       1.7144      0.00000
     11       4.2457      0.00000
     12       3.4908      0.00000
     13       1.6609      0.00000
     14      -1.7472      0.00000
     15       5.4403      0.00000
     16      -5.5808      0.00000
     17       3.8356      0.00000
     18      -1.3755      0.00000
     19     -10.0352      0.00000
     20      -1.4334      0.00000

 k-point 602 :       0.2917    0.1250   -0.1250
  band No.  band energies     occupation 
      1       0.0022      0.00000
      2      -2.9246      0.00000
      3       3.6129      0.00000
      4      -0.6614      0.00000
      5      -0.6364      0.00000
      6       2.1066      0.00000
      7      -4.8508      0.00000
      8       5.0233      0.00000
      9       0.0856      0.00000
     10      -2.0399      0.00000
     11      -0.0267      0.00000
     12      -1.3353      0.00000
     13       1.6326      0.00000
     14      -2.6702      0.00000
     15       1.2172      0.00000
     16      -0.0420      0.00000
     17      -0.1918      0.00000
     18       1.0037      0.00000
     19       1.3358      0.00000
     20       0.1967      0.00000

 k-point 603 :       0.1667   -0.2500   -0.1250
  band No.  band energies     occupation 
      1       0.0035      0.00000
      2      -1.8199      0.00000
      3       1.8930      0.00000
      4      -0.1122      0.00000
      5       1.9919      0.00000
      6      -1.6527      0.00000
      7       1.4181      0.00000
      8      -1.7934      0.00000
      9      13.7921      0.00000
     10     -13.8501      0.00000
     11       0.2836      0.00000
     12       1.2124      0.00000
     13      -1.5318      0.00000
     14      -0.1987      0.00000
     15      -1.6502      0.00000
     16      -2.1290      0.00000
     17       2.0325      0.00000
     18       0.9236      0.00000
     19       2.5462      0.00000
     20      -1.0849      0.00000

 k-point 604 :      -0.4167   -0.1667   -0.2917
  band No.  band energies     occupation 
      1      -0.0183      0.00000
      2      -6.0347      0.00000
      3      -1.0204      0.00000
      4       9.6382      0.00000
      5      -5.0556      0.00000
      6       8.0187      0.00000
      7      -5.3979      0.00000
      8       5.7102      0.00000
      9      -1.1988      0.00000
     10      -1.7144      0.00000
     11      -4.2457      0.00000
     12      -3.4908      0.00000
     13      -1.6609      0.00000
     14       1.7472      0.00000
     15      -5.4403      0.00000
     16       5.5808      0.00000
     17      -3.8356      0.00000
     18       1.3755      0.00000
     19      10.0352      0.00000
     20       1.4334      0.00000

 k-point 605 :       0.2500    0.4167    0.1250
  band No.  band energies     occupation 
      1      -0.0022      0.00000
      2       2.9246      0.00000
      3      -3.6129      0.00000
      4       0.6614      0.00000
      5       0.6364      0.00000
      6      -2.1066      0.00000
      7       4.8508      0.00000
      8      -5.0233      0.00000
      9      -0.0856      0.00000
     10       2.0399      0.00000
     11       0.0267      0.00000
     12       1.3353      0.00000
     13      -1.6326      0.00000
     14       2.6702      0.00000
     15      -1.2172      0.00000
     16       0.0420      0.00000
     17       0.1918      0.00000
     18      -1.0037      0.00000
     19      -1.3358      0.00000
     20      -0.1967      0.00000

 k-point 606 :       0.1250    0.3750    0.3750
  band No.  band energies     occupation 
      1       0.0079      0.00000
      2      -1.3243      0.00000
      3      -4.6154      0.00000
      4       5.9856      0.00000
      5       2.4958      0.00000
      6      -2.2019      0.00000
      7      -7.7991      0.00000
      8       6.5632      0.00000
      9      10.1796      0.00000
     10      -9.1961      0.00000
     11       1.6941      0.00000
     12      -0.8675      0.00000
     13       5.1402      0.00000
     14      -7.8432      0.00000
     15      -7.5584      0.00000
     16       8.8904      0.00000
     17      -2.9793      0.00000
     18       3.2854      0.00000
     19       2.0645      0.00000
     20      -9.3461      0.00000

 k-point 607 :       0.2500    0.2500   -0.1250
  band No.  band energies     occupation 
      1      -0.0047      0.00000
      2       5.0270      0.00000
      3      -6.3861      0.00000
      4       0.5651      0.00000
      5       1.4906      0.00000
      6      -1.8703      0.00000
      7      -3.8432      0.00000
      8       1.8290      0.00000
      9      -2.4269      0.00000
     10       3.8058      0.00000
     11       9.4606      0.00000
     12      -3.8068      0.00000
     13      -2.6156      0.00000
     14      -0.8618      0.00000
     15       3.1879      0.00000
     16       2.0596      0.00000
     17      -1.9168      0.00000
     18      -5.2331      0.00000
     19      -0.4442      0.00000
     20       5.1398      0.00000

 k-point 608 :       0.0000   -0.2500   -0.3750
  band No.  band energies     occupation 
      1      -0.0079      0.00000
      2       1.3243      0.00000
      3       4.6154      0.00000
      4      -5.9856      0.00000
      5      -2.4958      0.00000
      6       2.2019      0.00000
      7       7.7991      0.00000
      8      -6.5632      0.00000
      9     -10.1796      0.00000
     10       9.1961      0.00000
     11      -1.6941      0.00000
     12       0.8675      0.00000
     13      -5.1402      0.00000
     14       7.8432      0.00000
     15       7.5584      0.00000
     16      -8.8904      0.00000
     17       2.9793      0.00000
     18      -3.2854      0.00000
     19      -2.0645      0.00000
     20       9.3461      0.00000

 k-point 609 :       0.1250    0.4583    0.3750
  band No.  band energies     occupation 
      1       0.0157      0.00000
      2      -0.3270      0.00000
      3      -2.0981      0.00000
      4       2.4971      0.00000
      5       1.7377      0.00000
      6      -1.6860      0.00000
      7      -0.6997      0.00000
      8      -0.1672      0.00000
      9      13.7825      0.00000
     10     -13.2601      0.00000
     11       0.9429      0.00000
     12       1.0278      0.00000
     13      -0.0586      0.00000
     14      -3.3467      0.00000
     15      -1.3547      0.00000
     16       3.8817      0.00000
     17      -2.4656      0.00000
     18       1.4776      0.00000
     19       1.1715      0.00000
     20      -0.7922      0.00000

 k-point 610 :       0.3750    0.1250    0.4583
  band No.  band energies     occupation 
      1       0.0228      0.00000
      2      -2.5554      0.00000
      3       4.8370      0.00000
      4      -2.2154      0.00000
      5      -0.5008      0.00000
      6       0.7160      0.00000
      7       0.6686      0.00000
      8       0.0210      0.00000
      9       2.9194      0.00000
     10      -3.2268      0.00000
     11      -2.3967      0.00000
     12       0.0434      0.00000
     13      -0.1308      0.00000
     14      -0.8969      0.00000
     15       2.8944      0.00000
     16      -1.2797      0.00000
     17       0.0167      0.00000
     18       1.3115      0.00000
     19       1.4159      0.00000
     20      -3.5494      0.00000

 k-point 611 :       0.2500    0.3333   -0.1250
  band No.  band energies     occupation 
      1      -0.0738      0.00000
      2       5.9644      0.00000
      3      -0.8057      0.00000
      4      -6.1759      0.00000
      5       2.6780      0.00000
      6      -3.4475      0.00000
      7       0.5785      0.00000
      8      -3.1239      0.00000
      9       2.8319      0.00000
     10      -1.2192      0.00000
     11       8.7811      0.00000
     12       0.1213      0.00000
     13      -4.8296      0.00000
     14       4.9960      0.00000
     15      -1.7209      0.00000
     16       4.4248      0.00000
     17      -2.6959      0.00000
     18      -9.7513      0.00000
     19       5.6827      0.00000
     20       8.4224      0.00000

 k-point 612 :       0.0833   -0.2500   -0.3750
  band No.  band energies     occupation 
      1      -0.0157      0.00000
      2       0.3270      0.00000
      3       2.0981      0.00000
      4      -2.4971      0.00000
      5      -1.7377      0.00000
      6       1.6860      0.00000
      7       0.6997      0.00000
      8       0.1672      0.00000
      9     -13.7825      0.00000
     10      13.2601      0.00000
     11      -0.9429      0.00000
     12      -1.0278      0.00000
     13       0.0586      0.00000
     14       3.3467      0.00000
     15       1.3547      0.00000
     16      -3.8817      0.00000
     17       2.4656      0.00000
     18      -1.4776      0.00000
     19      -1.1715      0.00000
     20       0.7922      0.00000

 k-point 613 :      -0.3333   -0.0833   -0.4583
  band No.  band energies     occupation 
      1      -0.0228      0.00000
      2       2.5554      0.00000
      3      -4.8370      0.00000
      4       2.2154      0.00000
      5       0.5008      0.00000
      6      -0.7160      0.00000
      7      -0.6686      0.00000
      8      -0.0210      0.00000
      9      -2.9194      0.00000
     10       3.2268      0.00000
     11       2.3967      0.00000
     12      -0.0434      0.00000
     13       0.1308      0.00000
     14       0.8969      0.00000
     15      -2.8944      0.00000
     16       1.2797      0.00000
     17      -0.0167      0.00000
     18      -1.3115      0.00000
     19      -1.4159      0.00000
     20       3.5494      0.00000

 k-point 614 :       0.1250   -0.4583    0.3750
  band No.  band energies     occupation 
      1      -0.0684      0.00000
      2       0.3239      0.00000
      3       2.5454      0.00000
      4      -2.9495      0.00000
      5      -3.0600      0.00000
      6       3.0957      0.00000
      7       0.6592      0.00000
      8       0.6475      0.00000
      9      -4.7264      0.00000
     10       3.7347      0.00000
     11      -0.7946      0.00000
     12      -1.1713      0.00000
     13       1.8355      0.00000
     14       2.9458      0.00000
     15      -1.7580      0.00000
     16       1.0274      0.00000
     17       1.8872      0.00000
     18      -4.1545      0.00000
     19      -0.3335      0.00000
     20       0.8707      0.00000

 k-point 615 :       0.3750    0.1250   -0.4583
  band No.  band energies     occupation 
      1      -0.0878      0.00000
      2       2.2093      0.00000
      3      -4.3886      0.00000
      4       2.2571      0.00000
      5       0.9030      0.00000
      6      -1.3419      0.00000
      7      -0.4762      0.00000
      8       0.4119      0.00000
      9      -1.5839      0.00000
     10       1.4103      0.00000
     11       2.3294      0.00000
     12      -0.3597      0.00000
     13      -0.4187      0.00000
     14       1.5352      0.00000
     15      -3.2786      0.00000
     16       0.7075      0.00000
     17      -1.1822      0.00000
     18       2.0812      0.00000
     19      -0.2117      0.00000
     20       1.1910      0.00000

 k-point 616 :       0.2500   -0.5833   -0.1250
  band No.  band energies     occupation 
      1      -0.3428      0.00000
      2       5.3461      0.00000
      3      -0.5795      0.00000
      4      -5.2707      0.00000
      5       3.0927      0.00000
      6      -4.8309      0.00000
      7       1.7837      0.00000
      8      -4.6057      0.00000
      9       9.0135      0.00000
     10      -6.8297      0.00000
     11       8.5537      0.00000
     12      -3.1071      0.00000
     13      -4.3160      0.00000
     14       7.9668      0.00000
     15       1.1121      0.00000
     16      -4.2737      0.00000
     17     -12.4746      0.00000
     18       6.7826      0.00000
     19      11.7895      0.00000
     20      -2.6867      0.00000

 k-point 617 :      -0.8333   -0.2500   -0.3750
  band No.  band energies     occupation 
      1       0.0684      0.00000
      2      -0.3239      0.00000
      3      -2.5454      0.00000
      4       2.9495      0.00000
      5       3.0600      0.00000
      6      -3.0957      0.00000
      7      -0.6592      0.00000
      8      -0.6475      0.00000
      9       4.7264      0.00000
     10      -3.7347      0.00000
     11       0.7946      0.00000
     12       1.1713      0.00000
     13      -1.8355      0.00000
     14      -2.9458      0.00000
     15       1.7580      0.00000
     16      -1.0274      0.00000
     17      -1.8872      0.00000
     18       4.1545      0.00000
     19       0.3335      0.00000
     20      -0.8706      0.00000

 k-point 618 :       0.5833    0.8333    0.4583
  band No.  band energies     occupation 
      1       0.0878      0.00000
      2      -2.2093      0.00000
      3       4.3886      0.00000
      4      -2.2571      0.00000
      5      -0.9030      0.00000
      6       1.3419      0.00000
      7       0.4762      0.00000
      8      -0.4119      0.00000
      9       1.5839      0.00000
     10      -1.4103      0.00000
     11      -2.3294      0.00000
     12       0.3597      0.00000
     13       0.4187      0.00000
     14      -1.5352      0.00000
     15       3.2786      0.00000
     16      -0.7075      0.00000
     17       1.1822      0.00000
     18      -2.0812      0.00000
     19       0.2117      0.00000
     20      -1.1910      0.00000

 k-point 619 :       0.1250   -0.3750    0.3750
  band No.  band energies     occupation 
      1      -1.0303      0.00000
      2       2.3209      0.00000
      3       3.7067      0.00000
      4      -5.5521      0.00000
      5      -6.0489      0.00000
      6       7.3095      0.00000
      7       0.5319      0.00000
      8       1.8801      0.00000
      9      -5.0138      0.00000
     10       0.8221      0.00000
     11       0.1890      0.00000
     12      -1.7769      0.00000
     13       3.3080      0.00000
     14       3.7964      0.00000
     15       1.0578      0.00000
     16      -0.3572      0.00000
     17      -2.0121      0.00000
     18       7.5002      0.00000
     19       2.0608      0.00000
     20     -10.3892      0.00000

 k-point 620 :       0.3750    0.1250   -0.3750
  band No.  band energies     occupation 
      1      -0.9977      0.00000
      2       4.3421      0.00000
      3      -5.6313      0.00000
      4       2.3110      0.00000
      5       1.8392      0.00000
      6      -5.3328      0.00000
      7       0.9902      0.00000
      8       2.6232      0.00000
      9      -3.5701      0.00000
     10       2.1194      0.00000
     11       3.9460      0.00000
     12      -0.3742      0.00000
     13      -0.6643      0.00000
     14      -1.1518      0.00000
     15       0.3115      0.00000
     16       2.4330      0.00000
     17      -4.4411      0.00000
     18       2.5637      0.00000
     19      -0.8441      0.00000
     20       4.2297      0.00000

 k-point 621 :       0.2500   -0.5000   -0.1250
  band No.  band energies     occupation 
      1      -1.4155      0.00000
      2       4.8480      0.00000
      3      -1.8058      0.00000
      4      -2.0935      0.00000
      5       0.4726      0.00000
      6      -3.7557      0.00000
      7       3.5231      0.00000
      8      -4.0243      0.00000
      9       6.1563      0.00000
     10      -4.6885      0.00000
     11       5.5655      0.00000
     12      -3.3652      0.00000
     13      -0.7471      0.00000
     14       6.4428      0.00000
     15       2.8001      0.00000
     16      -1.5182      0.00000
     17       2.2010      0.00000
     18     -12.6709      0.00000
     19       2.0106      0.00000
     20       8.8451      0.00000

 k-point 622 :      -0.7500   -0.2500   -0.3750
  band No.  band energies     occupation 
      1       1.0303      0.00000
      2      -2.3209      0.00000
      3      -3.7067      0.00000
      4       5.5521      0.00000
      5       6.0489      0.00000
      6      -7.3095      0.00000
      7      -0.5319      0.00000
      8      -1.8801      0.00000
      9       5.0138      0.00000
     10      -0.8221      0.00000
     11      -0.1890      0.00000
     12       1.7769      0.00000
     13      -3.3080      0.00000
     14      -3.7964      0.00000
     15      -1.0578      0.00000
     16       0.3572      0.00000
     17       2.0121      0.00000
     18      -7.5002      0.00000
     19      -2.0608      0.00000
     20      10.3892      0.00000

 k-point 623 :       0.5000    0.7500    0.3750
  band No.  band energies     occupation 
      1       0.9977      0.00000
      2      -4.3421      0.00000
      3       5.6313      0.00000
      4      -2.3111      0.00000
      5      -1.8392      0.00000
      6       5.3328      0.00000
      7      -0.9902      0.00000
      8      -2.6232      0.00000
      9       3.5701      0.00000
     10      -2.1194      0.00000
     11      -3.9460      0.00000
     12       0.3742      0.00000
     13       0.6643      0.00000
     14       1.1518      0.00000
     15      -0.3115      0.00000
     16      -2.4330      0.00000
     17       4.4411      0.00000
     18      -2.5637      0.00000
     19       0.8441      0.00000
     20      -4.2297      0.00000

 k-point 624 :       0.1250   -0.2917    0.3750
  band No.  band energies     occupation 
      1      -1.6645      0.00000
      2       4.8176      0.00000
      3       2.1379      0.00000
      4      -6.3239      0.00000
      5      -6.8414      0.00000
      6       8.9142      0.00000
      7       1.7069      0.00000
      8      -2.3987      0.00000
      9       0.9654      0.00000
     10      -5.7559      0.00000
     11       3.6327      0.00000
     12      -1.4272      0.00000
     13       2.3251      0.00000
     14       2.5620      0.00000
     15       6.9623      0.00000
     16       1.5857      0.00000
     17       1.4060      0.00000
     18      -6.9082      0.00000
     19      13.9120      0.00000
     20     -16.1301      0.00000

 k-point 625 :       0.3750    0.1250   -0.2917
  band No.  band energies     occupation 
      1      -0.5243      0.00000
      2       2.9727      0.00000
      3      -3.2022      0.00000
      4       0.7780      0.00000
      5       1.2975      0.00000
      6      -5.1202      0.00000
      7      12.8501      0.00000
      8      -8.9091      0.00000
      9      -1.7461      0.00000
     10       1.2288      0.00000
     11       1.1595      0.00000
     12       0.3850      0.00000
     13      -1.8431      0.00000
     14       0.7214      0.00000
     15       3.4248      0.00000
     16      -2.0016      0.00000
     17      -0.1732      0.00000
     18      -1.4250      0.00000
     19       0.1545      0.00000
     20       1.2236      0.00000

 k-point 626 :       0.2500   -0.4167   -0.1250
  band No.  band energies     occupation 
      1      -0.5255      0.00000
      2       2.3051      0.00000
      3      -1.4296      0.00000
      4      -0.4787      0.00000
      5      -0.4671      0.00000
      6      -0.3048      0.00000
      7       3.8480      0.00000
      8      -3.8853      0.00000
      9       1.0994      0.00000
     10      -0.8139      0.00000
     11       1.1465      0.00000
     12      -1.6947      0.00000
     13       0.3884      0.00000
     14       5.0910      0.00000
     15       0.1075      0.00000
     16      -1.8207      0.00000
     17      -6.3828      0.00000
     18       7.4577      0.00000
     19      -3.8339      0.00000
     20       2.2482      0.00000

 k-point 627 :      -0.6667   -0.2500   -0.3750
  band No.  band energies     occupation 
      1       1.6645      0.00000
      2      -4.8176      0.00000
      3      -2.1379      0.00000
      4       6.3239      0.00000
      5       6.8414      0.00000
      6      -8.9142      0.00000
      7      -1.7069      0.00000
      8       2.3987      0.00000
      9      -0.9654      0.00000
     10       5.7559      0.00000
     11      -3.6327      0.00000
     12       1.4272      0.00000
     13      -2.3251      0.00000
     14      -2.5620      0.00000
     15      -6.9623      0.00000
     16      -1.5857      0.00000
     17      -1.4060      0.00000
     18       6.9082      0.00000
     19     -13.9120      0.00000
     20      16.1301      0.00000

 k-point 628 :       0.4167    0.6667    0.2917
  band No.  band energies     occupation 
      1       0.5243      0.00000
      2      -2.9727      0.00000
      3       3.2022      0.00000
      4      -0.7780      0.00000
      5      -1.2975      0.00000
      6       5.1202      0.00000
      7     -12.8502      0.00000
      8       8.9091      0.00000
      9       1.7461      0.00000
     10      -1.2288      0.00000
     11      -1.1595      0.00000
     12      -0.3850      0.00000
     13       1.8431      0.00000
     14      -0.7214      0.00000
     15      -3.4248      0.00000
     16       2.0016      0.00000
     17       0.1732      0.00000
     18       1.4250      0.00000
     19      -0.1545      0.00000
     20      -1.2236      0.00000

 k-point 629 :       0.1250   -0.2083    0.3750
  band No.  band energies     occupation 
      1      -0.5170      0.00000
      2       4.9293      0.00000
      3       1.2793      0.00000
      4      -7.2043      0.00000
      5      -7.8426      0.00000
      6       6.9133      0.00000
      7       3.7597      0.00000
      8      -8.6062      0.00000
      9       9.7680      0.00000
     10      -7.0234      0.00000
     11       3.7062      0.00000
     12       0.3573      0.00000
     13       3.6158      0.00000
     14       2.6956      0.00000
     15       6.1700      0.00000
     16      -3.2283      0.00000
     17      10.8301      0.00000
     18      -2.6123      0.00000
     19      -6.4298      0.00000
     20      -3.3372      0.00000

 k-point 630 :       0.3750    0.1250   -0.2083
  band No.  band energies     occupation 
      1       0.1343      0.00000
      2      -2.6607      0.00000
      3       3.3008      0.00000
      4      -0.8120      0.00000
      5      -4.2386      0.00000
      6       6.9046      0.00000
      7      -2.7469      0.00000
      8       1.5139      0.00000
      9       0.0718      0.00000
     10      -1.4423      0.00000
     11      -0.5548      0.00000
     12      -0.6599      0.00000
     13       1.2220      0.00000
     14      -2.3817      0.00000
     15       0.3031      0.00000
     16       0.8889      0.00000
     17       1.6830      0.00000
     18      -1.3947      0.00000
     19       1.9216      0.00000
     20      -0.1662      0.00000

 k-point 631 :       0.2500   -0.3333   -0.1250
  band No.  band energies     occupation 
      1       0.1226      0.00000
      2      -1.7189      0.00000
      3       1.3273      0.00000
      4       0.3616      0.00000
      5       2.6319      0.00000
      6      -2.3812      0.00000
      7       0.8205      0.00000
      8      -1.3129      0.00000
      9       0.6781      0.00000
     10      -0.5482      0.00000
     11      -0.2212      0.00000
     12       2.2641      0.00000
     13      -2.1722      0.00000
     14      -6.7007      0.00000
     15       4.3623      0.00000
     16      -0.2561      0.00000
     17       1.3268      0.00000
     18       3.0920      0.00000
     19      -4.5985      0.00000
     20       0.7999      0.00000

 k-point 632 :      -0.5833   -0.2500   -0.3750
  band No.  band energies     occupation 
      1       0.5170      0.00000
      2      -4.9293      0.00000
      3      -1.2793      0.00000
      4       7.2043      0.00000
      5       7.8426      0.00000
      6      -6.9133      0.00000
      7      -3.7597      0.00000
      8       8.6062      0.00000
      9      -9.7680      0.00000
     10       7.0234      0.00000
     11      -3.7062      0.00000
     12      -0.3573      0.00000
     13      -3.6158      0.00000
     14      -2.6956      0.00000
     15      -6.1700      0.00000
     16       3.2283      0.00000
     17     -10.8301      0.00000
     18       2.6123      0.00000
     19       6.4298      0.00000
     20       3.3372      0.00000

 k-point 633 :       0.3333    0.5833    0.2083
  band No.  band energies     occupation 
      1      -0.1343      0.00000
      2       2.6607      0.00000
      3      -3.3008      0.00000
      4       0.8120      0.00000
      5       4.2386      0.00000
      6      -6.9046      0.00000
      7       2.7469      0.00000
      8      -1.5139      0.00000
      9      -0.0718      0.00000
     10       1.4423      0.00000
     11       0.5548      0.00000
     12       0.6599      0.00000
     13      -1.2220      0.00000
     14       2.3817      0.00000
     15      -0.3031      0.00000
     16      -0.8889      0.00000
     17      -1.6830      0.00000
     18       1.3947      0.00000
     19      -1.9216      0.00000
     20       0.1662      0.00000

 k-point 634 :       0.1250   -0.1250    0.3750
  band No.  band energies     occupation 
      1      -0.1554      0.00000
      2       3.7036      0.00000
      3       2.8903      0.00000
      4      -8.2899      0.00000
      5       2.0512      0.00000
      6      -4.0643      0.00000
      7       5.5697      0.00000
      8      -8.7508      0.00000
      9       7.8122      0.00000
     10      -4.4422      0.00000
     11       2.8563      0.00000
     12       4.9807      0.00000
     13      -0.8268      0.00000
     14       7.3227      0.00000
     15      -0.8928      0.00000
     16      -2.8846      0.00000
     17       6.8379      0.00000
     18     -14.1542      0.00000
     19       3.0509      0.00000
     20      -6.2000      0.00000

 k-point 635 :       0.3750    0.1250   -0.1250
  band No.  band energies     occupation 
      1       0.1127      0.00000
      2      -3.0968      0.00000
      3       5.4265      0.00000
      4      -2.5176      0.00000
      5      -5.4236      0.00000
      6      10.3351      0.00000
      7      -8.8628      0.00000
      8       9.1704      0.00000
      9      -2.5645      0.00000
     10      -2.9461      0.00000
     11      -0.6723      0.00000
     12      -1.1146      0.00000
     13      -1.7735      0.00000
     14      -1.2591      0.00000
     15       0.3697      0.00000
     16       1.5187      0.00000
     17      -1.4371      0.00000
     18       2.0824      0.00000
     19       5.2084      0.00000
     20       1.0232      0.00000

 k-point 636 :       0.2500   -0.2500   -0.1250
  band No.  band energies     occupation 
      1       0.1003      0.00000
      2      -2.1825      0.00000
      3       1.4559      0.00000
      4       0.7572      0.00000
      5       7.7564      0.00000
      6      -6.9456      0.00000
      7       3.4889      0.00000
      8      -4.6254      0.00000
      9       3.8950      0.00000
     10      -4.1458      0.00000
     11       0.3960      0.00000
     12       2.9699      0.00000
     13      -1.7842      0.00000
     14      -6.6951      0.00000
     15      -2.6402      0.00000
     16      -1.5715      0.00000
     17       5.2259      0.00000
     18       6.7536      0.00000
     19       1.3346      0.00000
     20       2.5079      0.00000

 k-point 637 :      -0.5000   -0.2500   -0.3750
  band No.  band energies     occupation 
      1       0.1554      0.00000
      2      -3.7036      0.00000
      3      -2.8903      0.00000
      4       8.2899      0.00000
      5      -2.0512      0.00000
      6       4.0643      0.00000
      7      -5.5697      0.00000
      8       8.7508      0.00000
      9      -7.8122      0.00000
     10       4.4422      0.00000
     11      -2.8563      0.00000
     12      -4.9807      0.00000
     13       0.8268      0.00000
     14      -7.3227      0.00000
     15       0.8928      0.00000
     16       2.8846      0.00000
     17      -6.8379      0.00000
     18      14.1542      0.00000
     19      -3.0509      0.00000
     20       6.2000      0.00000

 k-point 638 :       0.2500    0.5000    0.1250
  band No.  band energies     occupation 
      1      -0.1127      0.00000
      2       3.0968      0.00000
      3      -5.4265      0.00000
      4       2.5176      0.00000
      5       5.4236      0.00000
      6     -10.3351      0.00000
      7       8.8628      0.00000
      8      -9.1704      0.00000
      9       2.5645      0.00000
     10       2.9461      0.00000
     11       0.6723      0.00000
     12       1.1146      0.00000
     13       1.7735      0.00000
     14       1.2591      0.00000
     15      -0.3697      0.00000
     16      -1.5187      0.00000
     17       1.4371      0.00000
     18      -2.0824      0.00000
     19      -5.2084      0.00000
     20      -1.0232      0.00000

 k-point 639 :       0.1250    0.4583    0.4583
  band No.  band energies     occupation 
      1       0.0567      0.00000
      2       0.0616      0.00000
      3      -5.2562      0.00000
      4       5.4053      0.00000
      5       3.3001      0.00000
      6      -3.3085      0.00000
      7      -9.1767      0.00000
      8       6.9624      0.00000
      9      15.8751      0.00000
     10     -15.3180      0.00000
     11       7.3008      0.00000
     12      -5.5372      0.00000
     13       0.8039      0.00000
     14      -2.7968      0.00000
     15      -6.0192      0.00000
     16       0.7260      0.00000
     17       9.6374      0.00000
     18      -2.9597      0.00000
     19       1.3483      0.00000
     20      -0.1787      0.00000

 k-point 640 :       0.3333    0.3333   -0.1250
  band No.  band energies     occupation 
      1      -0.1212      0.00000
      2       3.2123      0.00000
      3      -3.7584      0.00000
      4       0.3042      0.00000
      5       1.1854      0.00000
      6      -1.3704      0.00000
      7      -2.9178      0.00000
      8       1.2225      0.00000
      9      -1.7675      0.00000
     10       2.2150      0.00000
     11       6.5362      0.00000
     12      -0.8947      0.00000
     13       2.1812      0.00000
     14      -3.8355      0.00000
     15      -3.8553      0.00000
     16      -5.2371      0.00000
     17       5.6543      0.00000
     18       0.0611      0.00000
     19       3.7433      0.00000
     20       2.6396      0.00000

 k-point 641 :       0.0000   -0.3333   -0.4583
  band No.  band energies     occupation 
      1      -0.0567      0.00000
      2      -0.0616      0.00000
      3       5.2562      0.00000
      4      -5.4053      0.00000
      5      -3.3001      0.00000
      6       3.3085      0.00000
      7       9.1767      0.00000
      8      -6.9624      0.00000
      9     -15.8751      0.00000
     10      15.3180      0.00000
     11      -7.3008      0.00000
     12       5.5372      0.00000
     13      -0.8039      0.00000
     14       2.7968      0.00000
     15       6.0192      0.00000
     16      -0.7260      0.00000
     17      -9.6374      0.00000
     18       2.9597      0.00000
     19      -1.3483      0.00000
     20       0.1787      0.00000

 k-point 642 :       0.1250   -0.4583    0.4583
  band No.  band energies     occupation 
      1       0.0804      0.00000
      2       0.0036      0.00000
      3      -4.8791      0.00000
      4       4.9575      0.00000
      5       3.0792      0.00000
      6      -3.1083      0.00000
      7      -1.7605      0.00000
      8       0.3199      0.00000
      9      11.2208      0.00000
     10     -10.7263      0.00000
     11       5.2207      0.00000
     12      -3.8316      0.00000
     13      -1.9075      0.00000
     14      -0.6475      0.00000
     15       2.7070      0.00000
     16      -2.0319      0.00000
     17      -1.8609      0.00000
     18       0.3360      0.00000
     19       3.5035      0.00000
     20      -1.6211      0.00000

 k-point 643 :       0.4583    0.1250   -0.4583
  band No.  band energies     occupation 
      1       0.1120      0.00000
      2      -0.8535      0.00000
      3       2.0731      0.00000
      4      -1.2994      0.00000
      5      -0.4767      0.00000
      6       0.5653      0.00000
      7       0.9077      0.00000
      8      -0.7620      0.00000
      9       2.1506      0.00000
     10      -1.8818      0.00000
     11      -2.5275      0.00000
     12       1.1541      0.00000
     13      -2.0228      0.00000
     14       2.1345      0.00000
     15       2.3053      0.00000
     16       0.8647      0.00000
     17      -2.3151      0.00000
     18      -0.1802      0.00000
     19      -0.4681      0.00000
     20      -1.1601      0.00000

 k-point 644 :       0.3333   -0.5833   -0.1250
  band No.  band energies     occupation 
      1      -0.4002      0.00000
      2       2.5707      0.00000
      3      -1.2237      0.00000
      4      -1.3432      0.00000
      5       2.0659      0.00000
      6      -2.3158      0.00000
      7       0.7133      0.00000
      8      -3.0281      0.00000
      9       5.0345      0.00000
     10      -3.8764      0.00000
     11       6.7129      0.00000
     12      -2.3839      0.00000
     13       6.1274      0.00000
     14      -7.8414      0.00000
     15      -3.4153      0.00000
     16      -4.3047      0.00000
     17       3.5206      0.00000
     18       9.4946      0.00000
     19       1.5783      0.00000
     20      -3.0841      0.00000

 k-point 645 :      -0.9167   -0.3333   -0.4583
  band No.  band energies     occupation 
      1      -0.0804      0.00000
      2      -0.0036      0.00000
      3       4.8791      0.00000
      4      -4.9575      0.00000
      5      -3.0792      0.00000
      6       3.1083      0.00000
      7       1.7605      0.00000
      8      -0.3199      0.00000
      9     -11.2208      0.00000
     10      10.7263      0.00000
     11      -5.2207      0.00000
     12       3.8316      0.00000
     13       1.9075      0.00000
     14       0.6475      0.00000
     15      -2.7070      0.00000
     16       2.0319      0.00000
     17       1.8609      0.00000
     18      -0.3360      0.00000
     19      -3.5035      0.00000
     20       1.6211      0.00000

 k-point 646 :       0.5833    0.9167    0.4583
  band No.  band energies     occupation 
      1      -0.1120      0.00000
      2       0.8535      0.00000
      3      -2.0731      0.00000
      4       1.2994      0.00000
      5       0.4767      0.00000
      6      -0.5653      0.00000
      7      -0.9077      0.00000
      8       0.7620      0.00000
      9      -2.1506      0.00000
     10       1.8818      0.00000
     11       2.5275      0.00000
     12      -1.1541      0.00000
     13       2.0228      0.00000
     14      -2.1345      0.00000
     15      -2.3053      0.00000
     16      -0.8647      0.00000
     17       2.3151      0.00000
     18       0.1802      0.00000
     19       0.4681      0.00000
     20       1.1601      0.00000

 k-point 647 :       0.1250   -0.3750    0.4583
  band No.  band energies     occupation 
      1      -0.5524      0.00000
      2       0.5212      0.00000
      3       5.0189      0.00000
      4      -5.1826      0.00000
      5      -4.9932      0.00000
      6       5.0166      0.00000
      7       2.8201      0.00000
      8      -1.2722      0.00000
      9      -7.2757      0.00000
     10       6.1160      0.00000
     11      -2.7642      0.00000
     12       1.8919      0.00000
     13       5.0893      0.00000
     14      -1.5175      0.00000
     15      -4.5571      0.00000
     16       0.3729      0.00000
     17       2.6627      0.00000
     18       1.1726      0.00000
     19       3.0316      0.00000
     20      -3.3934      0.00000

 k-point 648 :       0.4583    0.1250   -0.3750
  band No.  band energies     occupation 
      1      -0.3531      0.00000
      2       0.7135      0.00000
      3      -1.0370      0.00000
      4       0.6750      0.00000
      5       0.3446      0.00000
      6      -0.4164      0.00000
      7      -0.8562      0.00000
      8       0.9769      0.00000
      9      -1.2607      0.00000
     10       1.0192      0.00000
     11       1.0434      0.00000
     12      -0.5466      0.00000
     13       1.3339      0.00000
     14      -1.8134      0.00000
     15      -0.7104      0.00000
     16       0.8449      0.00000
     17      -0.7844      0.00000
     18       1.4750      0.00000
     19      -1.3544      0.00000
     20       1.6010      0.00000

 k-point 649 :       0.3333   -0.5000   -0.1250
  band No.  band energies     occupation 
      1      -1.2767      0.00000
      2       2.3182      0.00000
      3      -0.4548      0.00000
      4      -0.7389      0.00000
      5       1.0405      0.00000
      6      -1.3106      0.00000
      7       1.4112      0.00000
      8      -2.4162      0.00000
      9       4.4665      0.00000
     10      -3.8899      0.00000
     11       3.3640      0.00000
     12      -2.0092      0.00000
     13       7.3878      0.00000
     14      -7.6828      0.00000
     15      -8.9079      0.00000
     16      13.0511      0.00000
     17      -0.1840      0.00000
     18      -2.7632      0.00000
     19      -8.9346      0.00000
     20      12.2298      0.00000

 k-point 650 :      -0.8333   -0.3333   -0.4583
  band No.  band energies     occupation 
      1       0.5524      0.00000
      2      -0.5212      0.00000
      3      -5.0189      0.00000
      4       5.1826      0.00000
      5       4.9932      0.00000
      6      -5.0166      0.00000
      7      -2.8201      0.00000
      8       1.2722      0.00000
      9       7.2757      0.00000
     10      -6.1160      0.00000
     11       2.7642      0.00000
     12      -1.8919      0.00000
     13      -5.0893      0.00000
     14       1.5175      0.00000
     15       4.5571      0.00000
     16      -0.3729      0.00000
     17      -2.6627      0.00000
     18      -1.1726      0.00000
     19      -3.0316      0.00000
     20       3.3934      0.00000

 k-point 651 :       0.5000    0.8333    0.3750
  band No.  band energies     occupation 
      1       0.3531      0.00000
      2      -0.7135      0.00000
      3       1.0370      0.00000
      4      -0.6750      0.00000
      5      -0.3446      0.00000
      6       0.4164      0.00000
      7       0.8562      0.00000
      8      -0.9769      0.00000
      9       1.2607      0.00000
     10      -1.0192      0.00000
     11      -1.0434      0.00000
     12       0.5466      0.00000
     13      -1.3339      0.00000
     14       1.8134      0.00000
     15       0.7104      0.00000
     16      -0.8449      0.00000
     17       0.7844      0.00000
     18      -1.4750      0.00000
     19       1.3544      0.00000
     20      -1.6010      0.00000

 k-point 652 :       0.1250   -0.2917    0.4583
  band No.  band energies     occupation 
      1      -2.7235      0.00000
      2       3.6598      0.00000
      3       4.1374      0.00000
      4      -5.6748      0.00000
      5      -5.8860      0.00000
      6       6.5374      0.00000
      7       3.1409      0.00000
      8      -0.3338      0.00000
      9      -4.4375      0.00000
     10       0.0921      0.00000
     11       0.4078      0.00000
     12      -0.9986      0.00000
     13       1.1563      0.00000
     14       3.6729      0.00000
     15       2.9605      0.00000
     16       2.6233      0.00000
     17      -6.3708      0.00000
     18       4.0623      0.00000
     19      10.5825      0.00000
     20     -11.6421      0.00000

 k-point 653 :       0.4583    0.1250   -0.2917
  band No.  band energies     occupation 
      1       1.2968      0.00000
      2      -3.0193      0.00000
      3       2.4462      0.00000
      4      -0.7322      0.00000
      5      -0.6129      0.00000
      6       1.5832      0.00000
      7       0.7180      0.00000
      8      -1.9118      0.00000
      9       1.7851      0.00000
     10      -1.0910      0.00000
     11      -1.3748      0.00000
     12       0.0456      0.00000
     13       1.8079      0.00000
     14      -0.4796      0.00000
     15      -3.0645      0.00000
     16       1.2998      0.00000
     17       2.5648      0.00000
     18      -3.1845      0.00000
     19       1.9529      0.00000
     20      -1.4758      0.00000

 k-point 654 :       0.3333   -0.4167   -0.1250
  band No.  band energies     occupation 
      1       1.7122      0.00000
      2      -3.4560      0.00000
      3       1.3192      0.00000
      4       0.5739      0.00000
      5      -0.1524      0.00000
      6       1.1081      0.00000
      7      -1.5133      0.00000
      8       1.7620      0.00000
      9      -2.2659      0.00000
     10       1.8969      0.00000
     11      -1.9371      0.00000
     12       1.2013      0.00000
     13       4.4747      0.00000
     14      -6.4418      0.00000
     15      -2.6830      0.00000
     16       0.9094      0.00000
     17       1.0053      0.00000
     18       0.1499      0.00000
     19       5.8441      0.00000
     20      -6.8300      0.00000

 k-point 655 :      -0.7500   -0.3333   -0.4583
  band No.  band energies     occupation 
      1       2.7235      0.00000
      2      -3.6598      0.00000
      3      -4.1374      0.00000
      4       5.6748      0.00000
      5       5.8860      0.00000
      6      -6.5374      0.00000
      7      -3.1409      0.00000
      8       0.3338      0.00000
      9       4.4375      0.00000
     10      -0.0921      0.00000
     11      -0.4078      0.00000
     12       0.9986      0.00000
     13      -1.1563      0.00000
     14      -3.6729      0.00000
     15      -2.9605      0.00000
     16      -2.6233      0.00000
     17       6.3708      0.00000
     18      -4.0623      0.00000
     19     -10.5825      0.00000
     20      11.6421      0.00000

 k-point 656 :       0.4167    0.7500    0.2917
  band No.  band energies     occupation 
      1      -1.2968      0.00000
      2       3.0193      0.00000
      3      -2.4462      0.00000
      4       0.7322      0.00000
      5       0.6129      0.00000
      6      -1.5832      0.00000
      7      -0.7180      0.00000
      8       1.9118      0.00000
      9      -1.7851      0.00000
     10       1.0910      0.00000
     11       1.3748      0.00000
     12      -0.0456      0.00000
     13      -1.8079      0.00000
     14       0.4796      0.00000
     15       3.0645      0.00000
     16      -1.2998      0.00000
     17      -2.5648      0.00000
     18       3.1845      0.00000
     19      -1.9529      0.00000
     20       1.4758      0.00000

 k-point 657 :       0.1250   -0.2083    0.4583
  band No.  band energies     occupation 
      1      -1.9450      0.00000
      2       4.4724      0.00000
      3       2.7880      0.00000
      4      -6.2698      0.00000
      5      -7.3264      0.00000
      6       8.0209      0.00000
      7      -2.3578      0.00000
      8       2.7618      0.00000
      9       0.4427      0.00000
     10      -4.5352      0.00000
     11       3.2317      0.00000
     12      -1.3911      0.00000
     13       2.7793      0.00000
     14       4.0450      0.00000
     15       4.2374      0.00000
     16       2.9635      0.00000
     17      -2.5017      0.00000
     18       5.7329      0.00000
     19      -2.1179      0.00000
     20      -7.8340      0.00000

 k-point 658 :       0.4583    0.1250   -0.2083
  band No.  band energies     occupation 
      1       1.5339      0.00000
      2      -4.6624      0.00000
      3       5.5422      0.00000
      4      -2.4875      0.00000
      5      -4.0640      0.00000
      6      10.7773      0.00000
      7      -7.3215      0.00000
      8       1.3656      0.00000
      9       3.0189      0.00000
     10      -2.3757      0.00000
     11      -3.8307      0.00000
     12      -0.2281      0.00000
     13       1.3095      0.00000
     14       1.8685      0.00000
     15      -5.0946      0.00000
     16      -0.7829      0.00000
     17       6.3868      0.00000
     18      -6.3081      0.00000
     19       5.1480      0.00000
     20      -0.3164      0.00000

 k-point 659 :       0.3333   -0.3333   -0.1250
  band No.  band energies     occupation 
      1       1.5714      0.00000
      2      -4.1183      0.00000
      3       1.1921      0.00000
      4       1.7622      0.00000
      5       1.5230      0.00000
      6       0.0728      0.00000
      7      -4.3258      0.00000
      8       5.8534      0.00000
      9      -3.9825      0.00000
     10       2.6490      0.00000
     11      -3.7438      0.00000
     12       3.8708      0.00000
     13      -3.3885      0.00000
     14      -7.2049      0.00000
     15      -0.5472      0.00000
     16       1.3492      0.00000
     17       4.2031      0.00000
     18       7.3458      0.00000
     19      -6.3012      0.00000
     20      -1.1939      0.00000

 k-point 660 :      -0.6667   -0.3333   -0.4583
  band No.  band energies     occupation 
      1       1.9450      0.00000
      2      -4.4724      0.00000
      3      -2.7880      0.00000
      4       6.2698      0.00000
      5       7.3264      0.00000
      6      -8.0209      0.00000
      7       2.3578      0.00000
      8      -2.7618      0.00000
      9      -0.4427      0.00000
     10       4.5352      0.00000
     11      -3.2317      0.00000
     12       1.3911      0.00000
     13      -2.7793      0.00000
     14      -4.0450      0.00000
     15      -4.2374      0.00000
     16      -2.9635      0.00000
     17       2.5017      0.00000
     18      -5.7329      0.00000
     19       2.1179      0.00000
     20       7.8340      0.00000

 k-point 661 :       0.3333    0.6667    0.2083
  band No.  band energies     occupation 
      1      -1.5339      0.00000
      2       4.6624      0.00000
      3      -5.5422      0.00000
      4       2.4875      0.00000
      5       4.0640      0.00000
      6     -10.7773      0.00000
      7       7.3215      0.00000
      8      -1.3656      0.00000
      9      -3.0189      0.00000
     10       2.3757      0.00000
     11       3.8307      0.00000
     12       0.2281      0.00000
     13      -1.3095      0.00000
     14      -1.8685      0.00000
     15       5.0946      0.00000
     16       0.7829      0.00000
     17      -6.3868      0.00000
     18       6.3081      0.00000
     19      -5.1480      0.00000
     20       0.3164      0.00000

 k-point 662 :       0.1250   -0.1250    0.4583
  band No.  band energies     occupation 
      1      -1.0483      0.00000
      2       3.6782      0.00000
      3       2.7538      0.00000
      4      -6.5272      0.00000
      5      -5.0446      0.00000
      6       3.9162      0.00000
      7       1.6399      0.00000
      8      -7.6928      0.00000
      9       8.9488      0.00000
     10      -5.5496      0.00000
     11       4.0125      0.00000
     12       1.3610      0.00000
     13       4.2297      0.00000
     14      -0.2246      0.00000
     15       6.3274      0.00000
     16      -1.8336      0.00000
     17       7.7036      0.00000
     18       3.8386      0.00000
     19     -11.5262      0.00000
     20      -9.4528      0.00000

 k-point 663 :       0.4583    0.1250   -0.1250
  band No.  band energies     occupation 
      1       0.9424      0.00000
      2      -3.6252      0.00000
      3       7.0576      0.00000
      4      -4.5282      0.00000
      5     -10.5575      0.00000
      6      16.9888      0.00000
      7      -6.8312      0.00000
      8       9.2338      0.00000
      9      -5.0186      0.00000
     10      -1.8578      0.00000
     11      -5.5144      0.00000
     12       0.6229      0.00000
     13      -0.8718      0.00000
     14      -4.5651      0.00000
     15       2.0493      0.00000
     16       0.2236      0.00000
     17       4.0824      0.00000
     18      -6.0472      0.00000
     19       3.6829      0.00000
     20       9.8077      0.00000

 k-point 664 :       0.3333   -0.2500   -0.1250
  band No.  band energies     occupation 
      1       0.8913      0.00000
      2      -3.1148      0.00000
      3      -0.5073      0.00000
      4       3.2860      0.00000
      5       9.1946      0.00000
      6      -8.1519      0.00000
      7       2.2291      0.00000
      8      -1.5113      0.00000
      9      -1.3455      0.00000
     10       0.7669      0.00000
     11      -2.6691      0.00000
     12       3.4322      0.00000
     13      -4.5930      0.00000
     14      -3.8172      0.00000
     15      -5.9061      0.00000
     16      -0.8550      0.00000
     17      -0.1340      0.00000
     18      16.9417      0.00000
     19      -0.2908      0.00000
     20      -2.9419      0.00000

 k-point 665 :      -0.5833   -0.3333   -0.4583
  band No.  band energies     occupation 
      1       1.0483      0.00000
      2      -3.6782      0.00000
      3      -2.7538      0.00000
      4       6.5272      0.00000
      5       5.0446      0.00000
      6      -3.9162      0.00000
      7      -1.6399      0.00000
      8       7.6928      0.00000
      9      -8.9488      0.00000
     10       5.5496      0.00000
     11      -4.0125      0.00000
     12      -1.3610      0.00000
     13      -4.2297      0.00000
     14       0.2246      0.00000
     15      -6.3274      0.00000
     16       1.8336      0.00000
     17      -7.7036      0.00000
     18      -3.8386      0.00000
     19      11.5262      0.00000
     20       9.4528      0.00000

 k-point 666 :       0.2500    0.5833    0.1250
  band No.  band energies     occupation 
      1      -0.9424      0.00000
      2       3.6252      0.00000
      3      -7.0576      0.00000
      4       4.5282      0.00000
      5      10.5575      0.00000
      6     -16.9888      0.00000
      7       6.8312      0.00000
      8      -9.2338      0.00000
      9       5.0186      0.00000
     10       1.8578      0.00000
     11       5.5144      0.00000
     12      -0.6229      0.00000
     13       0.8718      0.00000
     14       4.5651      0.00000
     15      -2.0493      0.00000
     16      -0.2236      0.00000
     17      -4.0824      0.00000
     18       6.0472      0.00000
     19      -3.6829      0.00000
     20      -9.8077      0.00000

 k-point 667 :       0.1250   -0.4583   -0.4583
  band No.  band energies     occupation 
      1       0.4390      0.00000
      2      -0.3220      0.00000
      3      -4.9396      0.00000
      4       5.1848      0.00000
      5       4.4546      0.00000
      6      -4.5832      0.00000
      7     -10.5640      0.00000
      8       7.3320      0.00000
      9      14.9713      0.00000
     10     -15.0832      0.00000
     11      10.0437      0.00000
     12      -7.1005      0.00000
     13      -5.2537      0.00000
     14       9.8633      0.00000
     15      -0.6151      0.00000
     16      -0.4121      0.00000
     17     -11.8180      0.00000
     18       5.8601      0.00000
     19      -6.4006      0.00000
     20       3.8855      0.00000

 k-point 668 :      -0.5833   -0.5833   -0.1250
  band No.  band energies     occupation 
      1      -0.4953      0.00000
      2       0.9483      0.00000
      3      -0.5783      0.00000
      4       0.0599      0.00000
      5       0.3397      0.00000
      6      -0.3802      0.00000
      7      -0.7133      0.00000
      8       0.3091      0.00000
      9      -0.3221      0.00000
     10       0.3442      0.00000
     11       1.2034      0.00000
     12      -0.0039      0.00000
     13       2.7247      0.00000
     14      -3.0568      0.00000
     15      -6.3835      0.00000
     16       7.4237      0.00000
     17      -3.0160      0.00000
     18       1.1210      0.00000
     19       2.8289      0.00000
     20       3.2201      0.00000

 k-point 669 :       0.0000    0.5833    0.4583
  band No.  band energies     occupation 
      1      -0.4390      0.00000
      2       0.3220      0.00000
      3       4.9396      0.00000
      4      -5.1848      0.00000
      5      -4.4546      0.00000
      6       4.5832      0.00000
      7      10.5640      0.00000
      8      -7.3320      0.00000
      9     -14.9713      0.00000
     10      15.0832      0.00000
     11     -10.0437      0.00000
     12       7.1005      0.00000
     13       5.2537      0.00000
     14      -9.8633      0.00000
     15       0.6151      0.00000
     16       0.4121      0.00000
     17      11.8180      0.00000
     18      -5.8601      0.00000
     19       6.4006      0.00000
     20      -3.8855      0.00000

 k-point 670 :       0.1250   -0.3750   -0.4583
  band No.  band energies     occupation 
      1       0.2748      0.00000
      2      -0.2130      0.00000
      3      -4.9945      0.00000
      4       5.1105      0.00000
      5       4.4189      0.00000
      6      -4.4686      0.00000
      7      -4.2502      0.00000
      8       2.6828      0.00000
      9      12.2381      0.00000
     10     -11.7865      0.00000
     11       6.6073      0.00000
     12      -5.3579      0.00000
     13      -4.9993      0.00000
     14       6.8873      0.00000
     15      -0.3015      0.00000
     16      -0.3581      0.00000
     17      -4.0155      0.00000
     18      -1.1358      0.00000
     19      -0.5096      0.00000
     20       2.6877      0.00000

 k-point 671 :      -0.4583    0.1250   -0.3750
  band No.  band energies     occupation 
      1      -0.2203      0.00000
      2       0.4327      0.00000
      3      -0.6356      0.00000
      4       0.4121      0.00000
      5       0.2409      0.00000
      6      -0.2673      0.00000
      7      -0.9277      0.00000
      8       0.9135      0.00000
      9      -1.0054      0.00000
     10       0.8748      0.00000
     11       0.9624      0.00000
     12      -0.4936      0.00000
     13       1.6211      0.00000
     14      -2.1344      0.00000
     15      -1.2782      0.00000
     16       1.4848      0.00000
     17      -0.5284      0.00000
     18       0.9405      0.00000
     19      -1.9090      0.00000
     20       2.8657      0.00000

 k-point 672 :      -0.5833   -0.5000   -0.1250
  band No.  band energies     occupation 
      1       0.7665      0.00000
      2      -1.4230      0.00000
      3       0.4232      0.00000
      4       0.3597      0.00000
      5      -0.9987      0.00000
      6       1.0817      0.00000
      7      -1.3005      0.00000
      8       2.2339      0.00000
      9      -2.2121      0.00000
     10       1.7266      0.00000
     11      -2.3818      0.00000
     12       0.9074      0.00000
     13      -5.8388      0.00000
     14       5.0767      0.00000
     15      11.3672      0.00000
     16     -12.3801      0.00000
     17      -0.4729      0.00000
     18       2.5182      0.00000
     19       6.6031      0.00000
     20     -11.2080      0.00000

 k-point 673 :       0.0833    0.5833    0.4583
  band No.  band energies     occupation 
      1      -0.2748      0.00000
      2       0.2130      0.00000
      3       4.9945      0.00000
      4      -5.1105      0.00000
      5      -4.4189      0.00000
      6       4.4686      0.00000
      7       4.2502      0.00000
      8      -2.6828      0.00000
      9     -12.2381      0.00000
     10      11.7865      0.00000
     11      -6.6073      0.00000
     12       5.3579      0.00000
     13       4.9993      0.00000
     14      -6.8873      0.00000
     15       0.3015      0.00000
     16       0.3581      0.00000
     17       4.0155      0.00000
     18       1.1358      0.00000
     19       0.5096      0.00000
     20      -2.6877      0.00000

 k-point 674 :       0.5000   -0.0833    0.3750
  band No.  band energies     occupation 
      1       0.2203      0.00000
      2      -0.4327      0.00000
      3       0.6356      0.00000
      4      -0.4121      0.00000
      5      -0.2409      0.00000
      6       0.2673      0.00000
      7       0.9277      0.00000
      8      -0.9135      0.00000
      9       1.0054      0.00000
     10      -0.8748      0.00000
     11      -0.9624      0.00000
     12       0.4936      0.00000
     13      -1.6211      0.00000
     14       2.1344      0.00000
     15       1.2782      0.00000
     16      -1.4848      0.00000
     17       0.5284      0.00000
     18      -0.9405      0.00000
     19       1.9090      0.00000
     20      -2.8657      0.00000

 k-point 675 :       0.1250   -0.2917   -0.4583
  band No.  band energies     occupation 
      1      -0.1560      0.00000
      2       0.1605      0.00000
      3       4.3467      0.00000
      4      -4.5300      0.00000
      5      -3.9508      0.00000
      6       3.9704      0.00000
      7       1.1840      0.00000
      8       0.3472      0.00000
      9      -5.5088      0.00000
     10       4.3710      0.00000
     11      -1.8500      0.00000
     12       0.5723      0.00000
     13       2.6549      0.00000
     14       1.4644      0.00000
     15      -3.3640      0.00000
     16       0.6378      0.00000
     17       1.7166      0.00000
     18       1.4853      0.00000
     19       0.9942      0.00000
     20      -3.6721      0.00000

 k-point 676 :      -0.4583    0.1250   -0.2917
  band No.  band energies     occupation 
      1       0.1779      0.00000
      2      -1.3767      0.00000
      3       3.0862      0.00000
      4      -1.8827      0.00000
      5      -0.7751      0.00000
      6       1.0075      0.00000
      7       0.7347      0.00000
      8      -0.9226      0.00000
      9       2.0356      0.00000
     10      -1.5503      0.00000
     11      -2.3529      0.00000
     12       0.9561      0.00000
     13      -1.4998      0.00000
     14       0.9131      0.00000
     15       2.8793      0.00000
     16      -0.6645      0.00000
     17      -0.9616      0.00000
     18       1.3023      0.00000
     19      -0.8585      0.00000
     20      -2.0293      0.00000

 k-point 677 :      -0.5833   -0.4167   -0.1250
  band No.  band energies     occupation 
      1       0.6846      0.00000
      2      -3.8731      0.00000
      3       0.9984      0.00000
      4       2.6626      0.00000
      5      -2.4391      0.00000
      6       3.3160      0.00000
      7      -1.2434      0.00000
      8       3.8544      0.00000
      9      -8.5062      0.00000
     10       6.9071      0.00000
     11      -7.9468      0.00000
     12       4.2069      0.00000
     13      -8.9863      0.00000
     14       7.5626      0.00000
     15       0.5679      0.00000
     16       2.6561      0.00000
     17      -6.8443      0.00000
     18       7.4118      0.00000
     19       2.9029      0.00000
     20      -9.4981      0.00000

 k-point 678 :       0.1667    0.5833    0.4583
  band No.  band energies     occupation 
      1       0.1560      0.00000
      2      -0.1605      0.00000
      3      -4.3467      0.00000
      4       4.5300      0.00000
      5       3.9508      0.00000
      6      -3.9704      0.00000
      7      -1.1840      0.00000
      8      -0.3472      0.00000
      9       5.5088      0.00000
     10      -4.3710      0.00000
     11       1.8500      0.00000
     12      -0.5723      0.00000
     13      -2.6549      0.00000
     14      -1.4644      0.00000
     15       3.3640      0.00000
     16      -0.6378      0.00000
     17      -1.7166      0.00000
     18      -1.4853      0.00000
     19      -0.9942      0.00000
     20       3.6721      0.00000

 k-point 679 :       0.4167   -0.1667    0.2917
  band No.  band energies     occupation 
      1      -0.1779      0.00000
      2       1.3767      0.00000
      3      -3.0862      0.00000
      4       1.8827      0.00000
      5       0.7751      0.00000
      6      -1.0075      0.00000
      7      -0.7347      0.00000
      8       0.9226      0.00000
      9      -2.0356      0.00000
     10       1.5503      0.00000
     11       2.3529      0.00000
     12      -0.9561      0.00000
     13       1.4998      0.00000
     14      -0.9131      0.00000
     15      -2.8793      0.00000
     16       0.6645      0.00000
     17       0.9616      0.00000
     18      -1.3023      0.00000
     19       0.8585      0.00000
     20       2.0293      0.00000

 k-point 680 :       0.1250   -0.2083   -0.4583
  band No.  band energies     occupation 
      1      -0.4506      0.00000
      2       2.0829      0.00000
      3       2.5305      0.00000
      4      -4.6260      0.00000
      5      -6.3789      0.00000
      6       8.1590      0.00000
      7      -1.2223      0.00000
      8       2.6972      0.00000
      9      -5.1119      0.00000
     10       1.7102      0.00000
     11       0.3506      0.00000
     12      -3.1833      0.00000
     13       3.8539      0.00000
     14       5.5489      0.00000
     15      -0.1741      0.00000
     16       1.6398      0.00000
     17      -0.3552      0.00000
     18       2.0773      0.00000
     19      -9.6865      0.00000
     20       2.7292      0.00000

 k-point 681 :      -0.4583    0.1250   -0.2083
  band No.  band energies     occupation 
      1       0.5057      0.00000
      2      -3.8975      0.00000
      3       7.0173      0.00000
      4      -3.6681      0.00000
      5      -3.0574      0.00000
      6       9.5269      0.00000
      7      -4.0313      0.00000
      8      -0.8428      0.00000
      9       2.2633      0.00000
     10      -2.0061      0.00000
     11      -5.2377      0.00000
     12       0.5733      0.00000
     13      -0.9047      0.00000
     14       1.8013      0.00000
     15       0.5080      0.00000
     16      -0.2466      0.00000
     17       1.4855      0.00000
     18       1.4464      0.00000
     19      -5.1103      0.00000
     20       0.2350      0.00000

 k-point 682 :      -0.5833   -0.3333   -0.1250
  band No.  band energies     occupation 
      1       0.7547      0.00000
      2      -4.3795      0.00000
      3      -0.0869      0.00000
      4       4.5472      0.00000
      5      -0.8319      0.00000
      6       6.3383      0.00000
      7      -5.8101      0.00000
      8       6.0217      0.00000
      9      -8.4433      0.00000
     10       5.8467      0.00000
     11      -7.3033      0.00000
     12       3.4945      0.00000
     13      -2.2456      0.00000
     14      -5.4023      0.00000
     15      -1.2505      0.00000
     16       2.5512      0.00000
     17      -5.5853      0.00000
     18      13.7078      0.00000
     19     -12.3042      0.00000
     20       5.6535      0.00000

 k-point 683 :       0.2500    0.5833    0.4583
  band No.  band energies     occupation 
      1       0.4506      0.00000
      2      -2.0829      0.00000
      3      -2.5305      0.00000
      4       4.6260      0.00000
      5       6.3789      0.00000
      6      -8.1590      0.00000
      7       1.2223      0.00000
      8      -2.6972      0.00000
      9       5.1119      0.00000
     10      -1.7102      0.00000
     11      -0.3506      0.00000
     12       3.1833      0.00000
     13      -3.8539      0.00000
     14      -5.5489      0.00000
     15       0.1741      0.00000
     16      -1.6398      0.00000
     17       0.3552      0.00000
     18      -2.0773      0.00000
     19       9.6865      0.00000
     20      -2.7292      0.00000

 k-point 684 :       0.3333   -0.2500    0.2083
  band No.  band energies     occupation 
      1      -0.5057      0.00000
      2       3.8975      0.00000
      3      -7.0173      0.00000
      4       3.6681      0.00000
      5       3.0574      0.00000
      6      -9.5269      0.00000
      7       4.0313      0.00000
      8       0.8428      0.00000
      9      -2.2633      0.00000
     10       2.0061      0.00000
     11       5.2377      0.00000
     12      -0.5733      0.00000
     13       0.9047      0.00000
     14      -1.8013      0.00000
     15      -0.5080      0.00000
     16       0.2466      0.00000
     17      -1.4855      0.00000
     18      -1.4464      0.00000
     19       5.1103      0.00000
     20      -0.2350      0.00000

 k-point 685 :       0.1250   -0.3750   -0.3750
  band No.  band energies     occupation 
      1       0.1300      0.00000
      2       0.0334      0.00000
      3      -5.0896      0.00000
      4       5.2558      0.00000
      5       3.9201      0.00000
      6      -4.0056      0.00000
      7     -10.0024      0.00000
      8       7.1825      0.00000
      9      15.3091      0.00000
     10     -15.1209      0.00000
     11       9.1928      0.00000
     12      -6.7861      0.00000
     13      -1.7133      0.00000
     14      -1.1873      0.00000
     15       5.9362      0.00000
     16     -10.0510      0.00000
     17       5.1139      0.00000
     18       0.0791      0.00000
     19       3.2405      0.00000
     20      -7.0283      0.00000

 k-point 686 :      -0.5000   -0.5000   -0.1250
  band No.  band energies     occupation 
      1       0.2553      0.00000
      2      -1.7989      0.00000
      3       1.9272      0.00000
      4      -0.1807      0.00000
      5      -0.8762      0.00000
      6       0.9942      0.00000
      7       1.9835      0.00000
      8      -0.8445      0.00000
      9       1.0015      0.00000
     10      -1.1485      0.00000
     11      -3.7008      0.00000
     12       0.1440      0.00000
     13      -3.7576      0.00000
     14       5.5594      0.00000
     15       4.9137      0.00000
     16       3.8925      0.00000
     17      -5.6866      0.00000
     18      -6.2004      0.00000
     19       0.4841      0.00000
     20      -3.2551      0.00000

 k-point 687 :       0.0000    0.5000    0.3750
  band No.  band energies     occupation 
      1      -0.1300      0.00000
      2      -0.0334      0.00000
      3       5.0896      0.00000
      4      -5.2558      0.00000
      5      -3.9201      0.00000
      6       4.0056      0.00000
      7      10.0024      0.00000
      8      -7.1825      0.00000
      9     -15.3091      0.00000
     10      15.1209      0.00000
     11      -9.1928      0.00000
     12       6.7861      0.00000
     13       1.7133      0.00000
     14       1.1873      0.00000
     15      -5.9362      0.00000
     16      10.0510      0.00000
     17      -5.1139      0.00000
     18      -0.0791      0.00000
     19      -3.2405      0.00000
     20       7.0283      0.00000

 k-point 688 :       0.1250   -0.2917   -0.3750
  band No.  band energies     occupation 
      1       0.0352      0.00000
      2       0.0028      0.00000
      3      -4.1486      0.00000
      4       4.2430      0.00000
      5       2.2128      0.00000
      6      -2.2080      0.00000
      7      -1.1106      0.00000
      8      -0.0578      0.00000
      9      11.2815      0.00000
     10     -10.7695      0.00000
     11       2.6973      0.00000
     12      -0.9532      0.00000
     13      -0.8306      0.00000
     14      -1.9416      0.00000
     15      -0.6103      0.00000
     16       0.8200      0.00000
     17      -1.5853      0.00000
     18       2.8324      0.00000
     19       0.7380      0.00000
     20      -1.1264      0.00000

 k-point 689 :      -0.3750    0.1250   -0.2917
  band No.  band energies     occupation 
      1      -0.0542      0.00000
      2       1.6130      0.00000
      3      -3.7756      0.00000
      4       2.1575      0.00000
      5       0.5212      0.00000
      6      -0.6674      0.00000
      7      -0.8216      0.00000
      8       0.3938      0.00000
      9      -2.4915      0.00000
     10       2.4357      0.00000
     11       2.9526      0.00000
     12      -0.9269      0.00000
     13       1.9419      0.00000
     14      -1.5601      0.00000
     15      -2.7124      0.00000
     16      -0.2333      0.00000
     17      -0.6798      0.00000
     18       1.9930      0.00000
     19       0.3909      0.00000
     20       1.1978      0.00000

 k-point 690 :      -0.5000   -0.4167   -0.1250
  band No.  band energies     occupation 
      1       0.1921      0.00000
      2      -4.2986      0.00000
      3       1.5783      0.00000
      4       3.2371      0.00000
      5      -2.4381      0.00000
      6       2.8828      0.00000
      7      -0.3665      0.00000
      8       3.1629      0.00000
      9      -4.9761      0.00000
     10       3.5061      0.00000
     11      -9.0158      0.00000
     12       2.1436      0.00000
     13      -1.3079      0.00000
     14       2.3481      0.00000
     15      -0.0069      0.00000
     16       8.1725      0.00000
     17       1.4150      0.00000
     18      -3.4723      0.00000
     19     -10.4445      0.00000
     20       1.8557      0.00000

 k-point 691 :       0.0833    0.5000    0.3750
  band No.  band energies     occupation 
      1      -0.0352      0.00000
      2      -0.0028      0.00000
      3       4.1486      0.00000
      4      -4.2430      0.00000
      5      -2.2128      0.00000
      6       2.2080      0.00000
      7       1.1106      0.00000
      8       0.0578      0.00000
      9     -11.2815      0.00000
     10      10.7695      0.00000
     11      -2.6973      0.00000
     12       0.9532      0.00000
     13       0.8306      0.00000
     14       1.9416      0.00000
     15       0.6103      0.00000
     16      -0.8200      0.00000
     17       1.5853      0.00000
     18      -2.8324      0.00000
     19      -0.7380      0.00000
     20       1.1264      0.00000

 k-point 692 :       0.4167   -0.0833    0.2917
  band No.  band energies     occupation 
      1       0.0542      0.00000
      2      -1.6130      0.00000
      3       3.7756      0.00000
      4      -2.1575      0.00000
      5      -0.5212      0.00000
      6       0.6674      0.00000
      7       0.8216      0.00000
      8      -0.3938      0.00000
      9       2.4915      0.00000
     10      -2.4357      0.00000
     11      -2.9526      0.00000
     12       0.9269      0.00000
     13      -1.9419      0.00000
     14       1.5601      0.00000
     15       2.7124      0.00000
     16       0.2333      0.00000
     17       0.6798      0.00000
     18      -1.9930      0.00000
     19      -0.3909      0.00000
     20      -1.1978      0.00000

 k-point 693 :       0.1250   -0.2083   -0.3750
  band No.  band energies     occupation 
      1      -0.0317      0.00000
      2       0.8052      0.00000
      3       0.4676      0.00000
      4      -1.3430      0.00000
      5      -2.5099      0.00000
      6       2.6187      0.00000
      7       0.2343      0.00000
      8       0.5732      0.00000
      9      -4.4867      0.00000
     10       3.7697      0.00000
     11      -0.2304      0.00000
     12      -2.3040      0.00000
     13       2.0381      0.00000
     14       3.9371      0.00000
     15      -1.7211      0.00000
     16       1.6248      0.00000
     17      -1.3990      0.00000
     18      -2.0608      0.00000
     19      -0.2763      0.00000
     20      -0.7624      0.00000

 k-point 694 :      -0.3750    0.1250   -0.2083
  band No.  band energies     occupation 
      1       0.0407      0.00000
      2      -2.7465      0.00000
      3       4.4005      0.00000
      4      -1.6787      0.00000
      5      -0.8933      0.00000
      6       1.7022      0.00000
      7       0.0454      0.00000
      8       0.1922      0.00000
      9       0.8560      0.00000
     10      -1.3438      0.00000
     11      -1.6128      0.00000
     12      -0.4701      0.00000
     13       0.5749      0.00000
     14      -2.9493      0.00000
     15       4.1284      0.00000
     16      -0.4347      0.00000
     17      -0.9746      0.00000
     18       0.8639      0.00000
     19       1.7288      0.00000
     20      -3.3064      0.00000

 k-point 695 :      -0.5000   -0.3333   -0.1250
  band No.  band energies     occupation 
      1       0.1491      0.00000
      2      -5.9731      0.00000
      3      -0.2156      0.00000
      4       7.3480      0.00000
      5      -3.5464      0.00000
      6       6.9974      0.00000
      7      -3.6810      0.00000
      8       4.7074      0.00000
      9      -8.1310      0.00000
     10       5.8093      0.00000
     11      -6.9596      0.00000
     12      -0.0659      0.00000
     13       2.0753      0.00000
     14      -7.1871      0.00000
     15       0.5953      0.00000
     16       4.2043      0.00000
     17      -5.3360      0.00000
     18      13.2419      0.00000
     19     -10.8781      0.00000
     20      -6.2768      0.00000

 k-point 696 :       0.1667    0.5000    0.3750
  band No.  band energies     occupation 
      1       0.0317      0.00000
      2      -0.8052      0.00000
      3      -0.4676      0.00000
      4       1.3430      0.00000
      5       2.5099      0.00000
      6      -2.6187      0.00000
      7      -0.2343      0.00000
      8      -0.5732      0.00000
      9       4.4867      0.00000
     10      -3.7697      0.00000
     11       0.2304      0.00000
     12       2.3040      0.00000
     13      -2.0381      0.00000
     14      -3.9371      0.00000
     15       1.7211      0.00000
     16      -1.6248      0.00000
     17       1.3990      0.00000
     18       2.0608      0.00000
     19       0.2763      0.00000
     20       0.7624      0.00000

 k-point 697 :       0.3333   -0.1667    0.2083
  band No.  band energies     occupation 
      1      -0.0407      0.00000
      2       2.7465      0.00000
      3      -4.4005      0.00000
      4       1.6787      0.00000
      5       0.8933      0.00000
      6      -1.7022      0.00000
      7      -0.0454      0.00000
      8      -0.1922      0.00000
      9      -0.8560      0.00000
     10       1.3438      0.00000
     11       1.6128      0.00000
     12       0.4701      0.00000
     13      -0.5749      0.00000
     14       2.9493      0.00000
     15      -4.1284      0.00000
     16       0.4347      0.00000
     17       0.9746      0.00000
     18      -0.8639      0.00000
     19      -1.7288      0.00000
     20       3.3064      0.00000

 k-point 698 :       0.1250   -0.2917   -0.2917
  band No.  band energies     occupation 
      1       0.0245      0.00000
      2      -0.4224      0.00000
      3      -5.0705      0.00000
      4       5.6429      0.00000
      5       2.8180      0.00000
      6      -2.7036      0.00000
      7      -8.3919      0.00000
      8       6.7308      0.00000
      9      15.3025      0.00000
     10     -14.4431      0.00000
     11       4.2395      0.00000
     12      -3.0857      0.00000
     13       3.7843      0.00000
     14      -5.5673      0.00000
     15      -8.4228      0.00000
     16       9.8263      0.00000
     17      -3.1973      0.00000
     18       2.7248      0.00000
     19       1.6647      0.00000
     20      -0.8883      0.00000

 k-point 699 :      -0.4167   -0.4167   -0.1250
  band No.  band energies     occupation 
      1       0.0462      0.00000
      2      -4.6216      0.00000
      3       5.5654      0.00000
      4      -0.4321      0.00000
      5      -1.3590      0.00000
      6       1.6103      0.00000
      7       3.5150      0.00000
      8      -1.5145      0.00000
      9       2.5537      0.00000
     10      -3.4049      0.00000
     11      -8.9919      0.00000
     12       2.4961      0.00000
     13       0.2006      0.00000
     14       0.7872      0.00000
     15       3.0995      0.00000
     16      -4.4786      0.00000
     17       1.2566      0.00000
     18       5.3992      0.00000
     19      -1.3533      0.00000
     20      -7.9713      0.00000

 k-point 700 :       0.0000    0.4167    0.2917
  band No.  band energies     occupation 
      1      -0.0245      0.00000
      2       0.4224      0.00000
      3       5.0705      0.00000
      4      -5.6429      0.00000
      5      -2.8180      0.00000
      6       2.7036      0.00000
      7       8.3919      0.00000
      8      -6.7308      0.00000
      9     -15.3025      0.00000
     10      14.4431      0.00000
     11      -4.2395      0.00000
     12       3.0857      0.00000
     13      -3.7843      0.00000
     14       5.5673      0.00000
     15       8.4228      0.00000
     16      -9.8263      0.00000
     17       3.1973      0.00000
     18      -2.7248      0.00000
     19      -1.6647      0.00000
     20       0.8883      0.00000

 k-point 701 :       0.1250   -0.2083   -0.2917
  band No.  band energies     occupation 
      1       0.0056      0.00000
      2      -0.9972      0.00000
      3       0.2489      0.00000
      4       0.7704      0.00000
      5       1.4696      0.00000
      6      -1.3708      0.00000
      7      -0.4143      0.00000
      8      -0.1633      0.00000
      9      11.3180      0.00000
     10     -10.8303      0.00000
     11       0.3010      0.00000
     12       1.2867      0.00000
     13      -0.6059      0.00000
     14      -1.2964      0.00000
     15      -3.0062      0.00000
     16       3.2318      0.00000
     17      -1.7225      0.00000
     18       1.6734      0.00000
     19       1.1564      0.00000
     20      -6.0223      0.00000

 k-point 702 :      -0.2917    0.1250   -0.2083
  band No.  band energies     occupation 
      1      -0.0056      0.00000
      2       3.1482      0.00000
      3      -4.6192      0.00000
      4       1.3467      0.00000
      5       0.4550      0.00000
      6      -0.7809      0.00000
      7      -0.5050      0.00000
      8      -0.2750      0.00000
      9      -2.2176      0.00000
     10       2.9577      0.00000
     11       1.6886      0.00000
     12       1.0769      0.00000
     13      -1.9653      0.00000
     14       3.6208      0.00000
     15      -3.0641      0.00000
     16       0.6555      0.00000
     17      -0.2555      0.00000
     18      -1.4835      0.00000
     19      -0.6089      0.00000
     20       1.1137      0.00000

 k-point 703 :      -0.4167   -0.3333   -0.1250
  band No.  band energies     occupation 
      1       0.0077      0.00000
      2      -6.6586      0.00000
      3      -0.2940      0.00000
      4       8.5100      0.00000
      5      -2.9792      0.00000
      6       4.7007      0.00000
      7      -1.8541      0.00000
      8       3.2176      0.00000
      9       2.6170      0.00000
     10      -4.4667      0.00000
     11      -7.6195      0.00000
     12      -0.9445      0.00000
     13       3.1336      0.00000
     14      -3.2388      0.00000
     15       0.1077      0.00000
     16      -3.8823      0.00000
     17       3.7898      0.00000
     18       9.0766      0.00000
     19      -0.8696      0.00000
     20     -12.4013      0.00000

 k-point 704 :       0.0833    0.4167    0.2917
  band No.  band energies     occupation 
      1      -0.0056      0.00000
      2       0.9972      0.00000
      3      -0.2489      0.00000
      4      -0.7704      0.00000
      5      -1.4696      0.00000
      6       1.3708      0.00000
      7       0.4143      0.00000
      8       0.1633      0.00000
      9     -11.3180      0.00000
     10      10.8303      0.00000
     11      -0.3010      0.00000
     12      -1.2867      0.00000
     13       0.6059      0.00000
     14       1.2964      0.00000
     15       3.0062      0.00000
     16      -3.2318      0.00000
     17       1.7225      0.00000
     18      -1.6734      0.00000
     19      -1.1564      0.00000
     20       6.0223      0.00000

 k-point 705 :       0.3333   -0.0833    0.2083
  band No.  band energies     occupation 
      1       0.0056      0.00000
      2      -3.1482      0.00000
      3       4.6192      0.00000
      4      -1.3467      0.00000
      5      -0.4550      0.00000
      6       0.7809      0.00000
      7       0.5050      0.00000
      8       0.2750      0.00000
      9       2.2176      0.00000
     10      -2.9577      0.00000
     11      -1.6886      0.00000
     12      -1.0769      0.00000
     13       1.9653      0.00000
     14      -3.6208      0.00000
     15       3.0641      0.00000
     16      -0.6555      0.00000
     17       0.2555      0.00000
     18       1.4835      0.00000
     19       0.6089      0.00000
     20      -1.1137      0.00000

 k-point 706 :       0.1250   -0.2083   -0.2083
  band No.  band energies     occupation 
      1      -0.0013      0.00000
      2      -2.1283      0.00000
      3       6.4647      0.00000
      4      -4.4184      0.00000
      5       2.2785      0.00000
      6      -1.7803      0.00000
      7      -7.4729      0.00000
      8       6.6146      0.00000
      9       4.6402      0.00000
     10      -3.8808      0.00000
     11       0.2060      0.00000
     12       0.5606      0.00000
     13      -2.4050      0.00000
     14       1.0906      0.00000
     15      -2.8455      0.00000
     16       2.3333      0.00000
     17      -3.2165      0.00000
     18       1.6668      0.00000
     19       3.7805      0.00000
     20      -9.6613      0.00000

 k-point 707 :      -0.3333   -0.3333   -0.1250
  band No.  band energies     occupation 
      1      -0.0169      0.00000
      2      -4.9001      0.00000
      3      -0.7044      0.00000
      4       6.7094      0.00000
      5      -1.6458      0.00000
      6       2.7023      0.00000
      7       3.9758      0.00000
      8      -2.6840      0.00000
      9       1.3323      0.00000
     10      -3.2601      0.00000
     11      -8.7307      0.00000
     12       4.4184      0.00000
     13       5.3767      0.00000
     14      -2.5747      0.00000
     15      -7.2774      0.00000
     16       0.7204      0.00000
     17       2.8260      0.00000
     18       1.1248      0.00000
     19       4.9150      0.00000
     20      -1.1846      0.00000

 k-point 708 :       0.0000    0.3333    0.2083
  band No.  band energies     occupation 
      1       0.0013      0.00000
      2       2.1283      0.00000
      3      -6.4647      0.00000
      4       4.4184      0.00000
      5      -2.2785      0.00000
      6       1.7803      0.00000
      7       7.4729      0.00000
      8      -6.6146      0.00000
      9      -4.6402      0.00000
     10       3.8808      0.00000
     11      -0.2060      0.00000
     12      -0.5606      0.00000
     13       2.4050      0.00000
     14      -1.0906      0.00000
     15       2.8455      0.00000
     16      -2.3333      0.00000
     17       3.2165      0.00000
     18      -1.6668      0.00000
     19      -3.7805      0.00000
     20       9.6613      0.00000

 k-point 709 :       0.0000    0.0000   -0.2083
  band No.  band energies     occupation 
      1       0.0297      0.00000
      2       4.0543      0.00000
      3     -11.3289      0.00000
      4       6.0211      0.00000
      5      -9.6617      0.00000
      6      11.1648      0.00000
      7      -2.6580      0.00000
      8      -2.1845      0.00000
      9       3.0594      0.00000
     10       1.5676      0.00000
     11       5.3676      0.00000
     12      -5.0825      0.00000
     13      -3.8405      0.00000
     14       6.3450      0.00000
     15      -1.0928      0.00000
     16      -9.5515      0.00000
     17       5.7227      0.00000
     18       6.5071      0.00000
     19      -5.2173      0.00000
     20       1.0628      0.00000

 k-point 710 :       0.2083    0.2917    0.2083
  band No.  band energies     occupation 
      1      -0.0203      0.00000
      2      -3.4095      0.00000
      3       4.9396      0.00000
      4      -1.4593      0.00000
      5       3.8593      0.00000
      6      -3.8022      0.00000
      7       1.8089      0.00000
      8       1.7358      0.00000
      9      -3.2458      0.00000
     10      -3.1250      0.00000
     11       1.6245      0.00000
     12       0.7269      0.00000
     13      -1.1394      0.00000
     14       0.0127      0.00000
     15       1.1028      0.00000
     16      -6.9456      0.00000
     17       4.0224      0.00000
     18      -1.1140      0.00000
     19       5.4329      0.00000
     20       0.8846      0.00000

 k-point 711 :      -0.0000    0.0833   -0.2083
  band No.  band energies     occupation 
      1       0.0496      0.00000
      2       4.4450      0.00000
      3       4.2614      0.00000
      4     -12.2710      0.00000
      5      13.1388      0.00000
      6      -9.0423      0.00000
      7      -4.9605      0.00000
      8      -2.1231      0.00000
      9       0.3235      0.00000
     10       4.1537      0.00000
     11       6.1679      0.00000
     12      -2.5343      0.00000
     13      -0.5318      0.00000
     14       6.9385      0.00000
     15       6.0191      0.00000
     16       6.6756      0.00000
     17      -7.0021      0.00000
     18      -9.5213      0.00000
     19      -0.7395      0.00000
     20      -1.2103      0.00000

 k-point 712 :       0.0833    0.0000   -0.2083
  band No.  band energies     occupation 
      1       0.0203      0.00000
      2       3.4095      0.00000
      3      -4.9396      0.00000
      4       1.4593      0.00000
      5      -3.8593      0.00000
      6       3.8022      0.00000
      7      -1.8089      0.00000
      8      -1.7358      0.00000
      9       3.2458      0.00000
     10       3.1250      0.00000
     11      -1.6245      0.00000
     12      -0.7269      0.00000
     13       1.1394      0.00000
     14      -0.0127      0.00000
     15      -1.1028      0.00000
     16       6.9456      0.00000
     17      -4.0224      0.00000
     18       1.1140      0.00000
     19      -5.4329      0.00000
     20      -0.8846      0.00000

 k-point 713 :       0.2083    0.3750    0.2083
  band No.  band energies     occupation 
      1      -0.0037      0.00000
      2      -2.5882      0.00000
      3       2.9842      0.00000
      4      -0.4817      0.00000
      5       1.5155      0.00000
      6      -0.0960      0.00000
      7      -0.6398      0.00000
      8       0.8193      0.00000
      9      -1.2911      0.00000
     10      -1.3850      0.00000
     11       1.1963      0.00000
     12      -0.3184      0.00000
     13       0.0108      0.00000
     14      -0.1721      0.00000
     15      -1.1327      0.00000
     16      -3.2708      0.00000
     17       2.6701      0.00000
     18       0.4658      0.00000
     19       0.7592      0.00000
     20       2.0609      0.00000

 k-point 714 :       0.0000    0.1667   -0.2083
  band No.  band energies     occupation 
      1       0.0535      0.00000
      2       5.9804      0.00000
      3       1.2687      0.00000
      4     -11.2494      0.00000
      5      13.5415      0.00000
      6      -3.2608      0.00000
      7     -13.5060      0.00000
      8       0.8261      0.00000
      9      -1.4028      0.00000
     10       5.7851      0.00000
     11       2.6241      0.00000
     12       2.7359      0.00000
     13       2.4991      0.00000
     14       0.7296      0.00000
     15       7.0915      0.00000
     16      -7.9304      0.00000
     17       7.1542      0.00000
     18      -7.8569      0.00000
     19       1.1511      0.00000
     20      -5.4914      0.00000

 k-point 715 :       0.1667    0.0000   -0.2083
  band No.  band energies     occupation 
      1       0.0037      0.00000
      2       2.5882      0.00000
      3      -2.9842      0.00000
      4       0.4817      0.00000
      5      -1.5155      0.00000
      6       0.0960      0.00000
      7       0.6398      0.00000
      8      -0.8193      0.00000
      9       1.2911      0.00000
     10       1.3850      0.00000
     11      -1.1963      0.00000
     12       0.3184      0.00000
     13      -0.0108      0.00000
     14       0.1721      0.00000
     15       1.1327      0.00000
     16       3.2708      0.00000
     17      -2.6701      0.00000
     18      -0.4658      0.00000
     19      -0.7592      0.00000
     20      -2.0609      0.00000

 k-point 716 :       0.2083    0.4583    0.2083
  band No.  band energies     occupation 
      1      -0.0111      0.00000
      2       2.3041      0.00000
      3      -2.6111      0.00000
      4       0.3949      0.00000
      5       0.1164      0.00000
      6      -1.5699      0.00000
      7       0.8266      0.00000
      8      -1.3068      0.00000
      9       1.5277      0.00000
     10       1.4277      0.00000
     11      -1.1798      0.00000
     12      -0.2000      0.00000
     13       0.4051      0.00000
     14       2.0723      0.00000
     15      -0.9902      0.00000
     16       1.7147      0.00000
     17      -1.3374      0.00000
     18      -0.4293      0.00000
     19      -0.8231      0.00000
     20      -1.6443      0.00000

 k-point 717 :       0.0000    0.2500   -0.2083
  band No.  band energies     occupation 
      1      -0.0058      0.00000
      2       5.2285      0.00000
      3       1.2045      0.00000
      4      -9.6505      0.00000
      5      -5.1878      0.00000
      6      13.3109      0.00000
      7     -13.3702      0.00000
      8       2.1275      0.00000
      9       7.7174      0.00000
     10      -3.2061      0.00000
     11       0.3225      0.00000
     12       6.1879      0.00000
     13       4.5844      0.00000
     14      -2.3959      0.00000
     15       7.1827      0.00000
     16      -6.4813      0.00000
     17      10.9961      0.00000
     18      -9.5752      0.00000
     19      -2.9191      0.00000
     20     -11.8169      0.00000

 k-point 718 :       0.2500    0.0000   -0.2083
  band No.  band energies     occupation 
      1       0.0111      0.00000
      2      -2.3041      0.00000
      3       2.6111      0.00000
      4      -0.3949      0.00000
      5      -0.1164      0.00000
      6       1.5699      0.00000
      7      -0.8266      0.00000
      8       1.3068      0.00000
      9      -1.5277      0.00000
     10      -1.4277      0.00000
     11       1.1798      0.00000
     12       0.2000      0.00000
     13      -0.4051      0.00000
     14      -2.0723      0.00000
     15       0.9902      0.00000
     16      -1.7147      0.00000
     17       1.3374      0.00000
     18       0.4293      0.00000
     19       0.8231      0.00000
     20       1.6443      0.00000

 k-point 719 :       0.2083   -0.4583    0.2083
  band No.  band energies     occupation 
      1      -0.2061      0.00000
      2       2.6639      0.00000
      3      -3.2717      0.00000
      4       0.9072      0.00000
      5       0.4243      0.00000
      6      -4.3023      0.00000
      7       2.0235      0.00000
      8      -5.6268      0.00000
      9       6.1585      0.00000
     10       4.2334      0.00000
     11      -2.8241      0.00000
     12      -0.8675      0.00000
     13       1.5687      0.00000
     14       4.1577      0.00000
     15       4.8369      0.00000
     16      -3.2686      0.00000
     17      -6.3570      0.00000
     18      -1.3041      0.00000
     19      -0.5435      0.00000
     20      -1.3534      0.00000

 k-point 720 :       0.0000   -0.6667   -0.2083
  band No.  band energies     occupation 
      1      -0.3071      0.00000
      2       3.3863      0.00000
      3       2.9368      0.00000
      4      -8.3241      0.00000
      5      -6.1285      0.00000
      6      12.5917      0.00000
      7      -8.4946      0.00000
      8      -3.3725      0.00000
      9       9.4618      0.00000
     10      -4.4604      0.00000
     11      -1.0899      0.00000
     12       7.2330      0.00000
     13       0.8359      0.00000
     14      -3.2193      0.00000
     15       8.8179      0.00000
     16       0.4716      0.00000
     17      10.7930      0.00000
     18     -10.9907      0.00000
     19      -5.8402      0.00000
     20      -6.8111      0.00000

 k-point 721 :      -0.6667    0.0000   -0.2083
  band No.  band energies     occupation 
      1       0.2061      0.00000
      2      -2.6639      0.00000
      3       3.2717      0.00000
      4      -0.9072      0.00000
      5      -0.4243      0.00000
      6       4.3023      0.00000
      7      -2.0235      0.00000
      8       5.6268      0.00000
      9      -6.1585      0.00000
     10      -4.2334      0.00000
     11       2.8241      0.00000
     12       0.8675      0.00000
     13      -1.5687      0.00000
     14      -4.1577      0.00000
     15      -4.8369      0.00000
     16       3.2686      0.00000
     17       6.3570      0.00000
     18       1.3041      0.00000
     19       0.5435      0.00000
     20       1.3534      0.00000

 k-point 722 :       0.2083   -0.3750    0.2083
  band No.  band energies     occupation 
      1      -1.5613      0.00000
      2       4.0622      0.00000
      3      -3.6992      0.00000
      4       1.1273      0.00000
      5       0.8014      0.00000
      6      -5.9220      0.00000
      7       1.8486      0.00000
      8      -7.0213      0.00000
      9       8.5602      0.00000
     10       6.6144      0.00000
     11      -3.0811      0.00000
     12      -1.4085      0.00000
     13       4.8023      0.00000
     14       2.8692      0.00000
     15       1.6843      0.00000
     16      -0.7432      0.00000
     17      -5.6246      0.00000
     18      -8.1196      0.00000
     19       4.6699      0.00000
     20      -4.7932      0.00000

 k-point 723 :       0.0000   -0.5833   -0.2083
  band No.  band energies     occupation 
      1      -1.6613      0.00000
      2       4.0046      0.00000
      3       3.5839      0.00000
      4      -7.3757      0.00000
      5      -6.4187      0.00000
      6      11.3850      0.00000
      7      -5.4635      0.00000
      8      -0.6041      0.00000
      9       2.5120      0.00000
     10      -5.1374      0.00000
     11      -0.3705      0.00000
     12       6.5381      0.00000
     13      -0.8378      0.00000
     14       2.8570      0.00000
     15       9.3729      0.00000
     16      -0.6025      0.00000
     17      13.3141      0.00000
     18     -14.9833      0.00000
     19      -5.6871      0.00000
     20      -5.2518      0.00000

 k-point 724 :      -0.5833    0.0000   -0.2083
  band No.  band energies     occupation 
      1       1.5613      0.00000
      2      -4.0622      0.00000
      3       3.6992      0.00000
      4      -1.1273      0.00000
      5      -0.8014      0.00000
      6       5.9220      0.00000
      7      -1.8486      0.00000
      8       7.0213      0.00000
      9      -8.5602      0.00000
     10      -6.6144      0.00000
     11       3.0811      0.00000
     12       1.4085      0.00000
     13      -4.8023      0.00000
     14      -2.8692      0.00000
     15      -1.6843      0.00000
     16       0.7432      0.00000
     17       5.6246      0.00000
     18       8.1196      0.00000
     19      -4.6699      0.00000
     20       4.7932      0.00000

 k-point 725 :       0.2083   -0.2917    0.2083
  band No.  band energies     occupation 
      1      -0.5341      0.00000
      2       3.3833      0.00000
      3      -4.3675      0.00000
      4       1.1305      0.00000
      5       1.2632      0.00000
      6      -6.3554      0.00000
      7      -3.1518      0.00000
      8       1.4044      0.00000
      9       5.1836      0.00000
     10      -1.9376      0.00000
     11       9.0982      0.00000
     12      -2.4409      0.00000
     13       3.5424      0.00000
     14       1.5696      0.00000
     15       0.1116      0.00000
     16      -4.5471      0.00000
     17       8.5240      0.00000
     18      -9.0889      0.00000
     19       1.1826      0.00000
     20     -12.5298      0.00000

 k-point 726 :       0.0000   -0.5000   -0.2083
  band No.  band energies     occupation 
      1      -0.4574      0.00000
      2       2.4739      0.00000
      3       4.0329      0.00000
      4      -6.7699      0.00000
      5      -6.2752      0.00000
      6      10.0364      0.00000
      7      -2.1108      0.00000
      8       0.4572      0.00000
      9      -4.7175      0.00000
     10       2.7677      0.00000
     11      -5.2819      0.00000
     12       4.6440      0.00000
     13       0.1556      0.00000
     14       4.5642      0.00000
     15       8.8543      0.00000
     16       8.7287      0.00000
     17     -10.2010      0.00000
     18     -11.1562      0.00000
     19      -6.7297      0.00000
     20      11.9253      0.00000

 k-point 727 :      -0.5000    0.0000   -0.2083
  band No.  band energies     occupation 
      1       0.5341      0.00000
      2      -3.3833      0.00000
      3       4.3675      0.00000
      4      -1.1305      0.00000
      5      -1.2632      0.00000
      6       6.3554      0.00000
      7       3.1518      0.00000
      8      -1.4044      0.00000
      9      -5.1836      0.00000
     10       1.9376      0.00000
     11      -9.0982      0.00000
     12       2.4409      0.00000
     13      -3.5424      0.00000
     14      -1.5696      0.00000
     15      -0.1116      0.00000
     16       4.5471      0.00000
     17      -8.5240      0.00000
     18       9.0889      0.00000
     19      -1.1826      0.00000
     20      12.5298      0.00000

 k-point 728 :       0.2083   -0.2083    0.2083
  band No.  band energies     occupation 
      1      -0.0568      0.00000
      2       3.6760      0.00000
      3      -5.3905      0.00000
      4       0.9853      0.00000
      5       1.7048      0.00000
      6      -4.5698      0.00000
      7      -5.7505      0.00000
      8       4.0262      0.00000
      9       2.5719      0.00000
     10       0.1237      0.00000
     11      10.5853      0.00000
     12      -3.7167      0.00000
     13       1.4568      0.00000
     14       2.9985      0.00000
     15      -4.1443      0.00000
     16      -1.6862      0.00000
     17       3.9901      0.00000
     18      -7.3616      0.00000
     19      -1.1602      0.00000
     20      -5.8925      0.00000

 k-point 729 :       0.0000   -0.4167   -0.2083
  band No.  band energies     occupation 
      1      -0.0493      0.00000
      2       1.9758      0.00000
      3       4.3677      0.00000
      4      -6.4649      0.00000
      5      -5.0889      0.00000
      6       4.3830      0.00000
      7       8.6990      0.00000
      8      -6.5486      0.00000
      9     -10.0377      0.00000
     10       8.2680      0.00000
     11      -3.0393      0.00000
     12       2.3886      0.00000
     13      -2.4870      0.00000
     14       7.8208      0.00000
     15       7.7689      0.00000
     16       4.4005      0.00000
     17      -9.9443      0.00000
     18      -7.4990      0.00000
     19      -3.5719      0.00000
     20      12.0095      0.00000

 k-point 730 :      -0.4167    0.0000   -0.2083
  band No.  band energies     occupation 
      1       0.0568      0.00000
      2      -3.6760      0.00000
      3       5.3905      0.00000
      4      -0.9853      0.00000
      5      -1.7048      0.00000
      6       4.5698      0.00000
      7       5.7505      0.00000
      8      -4.0262      0.00000
      9      -2.5719      0.00000
     10      -0.1237      0.00000
     11     -10.5853      0.00000
     12       3.7167      0.00000
     13      -1.4568      0.00000
     14      -2.9985      0.00000
     15       4.1443      0.00000
     16       1.6862      0.00000
     17      -3.9901      0.00000
     18       7.3616      0.00000
     19       1.1602      0.00000
     20       5.8925      0.00000

 k-point 731 :       0.2083    0.2917    0.2917
  band No.  band energies     occupation 
      1      -0.0188      0.00000
      2      -2.9201      0.00000
      3       8.6181      0.00000
      4      -6.0007      0.00000
      5       5.7390      0.00000
      6      -9.1207      0.00000
      7       6.1444      0.00000
      8       0.0890      0.00000
      9       0.4473      0.00000
     10      -3.7601      0.00000
     11      -0.6312      0.00000
     12       1.2478      0.00000
     13      -6.6598      0.00000
     14       5.6389      0.00000
     15       6.0980      0.00000
     16      -7.5274      0.00000
     17      -6.4006      0.00000
     18       2.8610      0.00000
     19      10.4440      0.00000
     20      -0.8673      0.00000

 k-point 732 :       0.0833    0.0833   -0.2083
  band No.  band energies     occupation 
      1       0.0366      0.00000
      2       3.6020      0.00000
      3       1.6406      0.00000
      4      -6.8610      0.00000
      5       2.9836      0.00000
      6      -5.8718      0.00000
      7       0.8351      0.00000
      8      -2.7698      0.00000
      9       4.9101      0.00000
     10       1.0631      0.00000
     11       7.4727      0.00000
     12      -5.4344      0.00000
     13      -2.5186      0.00000
     14       7.1839      0.00000
     15       2.3646      0.00000
     16       4.0461      0.00000
     17      -3.7780      0.00000
     18      -4.0121      0.00000
     19      -3.8560      0.00000
     20      -2.2706      0.00000

 k-point 733 :       0.0000   -0.0833   -0.2917
  band No.  band energies     occupation 
      1       0.0188      0.00000
      2       2.9201      0.00000
      3      -8.6181      0.00000
      4       6.0007      0.00000
      5      -5.7390      0.00000
      6       9.1207      0.00000
      7      -6.1444      0.00000
      8      -0.0890      0.00000
      9      -0.4473      0.00000
     10       3.7601      0.00000
     11       0.6312      0.00000
     12      -1.2478      0.00000
     13       6.6598      0.00000
     14      -5.6389      0.00000
     15      -6.0980      0.00000
     16       7.5274      0.00000
     17       6.4006      0.00000
     18      -2.8610      0.00000
     19     -10.4440      0.00000
     20       0.8673      0.00000

 k-point 734 :       0.2083    0.3750    0.2917
  band No.  band energies     occupation 
      1      -0.0035      0.00000
      2      -2.5707      0.00000
      3       3.6674      0.00000
      4      -1.3259      0.00000
      5       5.0536      0.00000
      6      -2.9476      0.00000
      7       0.1550      0.00000
      8      -0.8943      0.00000
      9       9.3596      0.00000
     10     -11.3973      0.00000
     11       1.2321      0.00000
     12      -0.1893      0.00000
     13      -1.1704      0.00000
     14       0.5087      0.00000
     15      -4.6997      0.00000
     16      -6.9874      0.00000
     17       5.9365      0.00000
     18       1.5732      0.00000
     19       8.2365      0.00000
     20      -1.3019      0.00000

 k-point 735 :       0.2917    0.2083    0.3750
  band No.  band energies     occupation 
      1      -0.0100      0.00000
      2      -3.2329      0.00000
      3       4.5874      0.00000
      4      -1.1811      0.00000
      5      -0.9539      0.00000
      6       4.1878      0.00000
      7      -1.4726      0.00000
      8       3.0367      0.00000
      9      -4.4567      0.00000
     10      -2.2257      0.00000
     11       0.8906      0.00000
     12      -0.7152      0.00000
     13       1.7709      0.00000
     14      -3.1739      0.00000
     15      -4.2953      0.00000
     16      -2.4776      0.00000
     17       4.0512      0.00000
     18       2.3811      0.00000
     19       3.7810      0.00000
     20       1.6103      0.00000

 k-point 736 :       0.0833    0.1667   -0.2083
  band No.  band energies     occupation 
      1       0.0377      0.00000
      2       4.0279      0.00000
      3       3.6628      0.00000
      4     -10.5657      0.00000
      5       5.6301      0.00000
      6      -3.3759      0.00000
      7      -5.5946      0.00000
      8      -0.3594      0.00000
      9      -0.1785      0.00000
     10       3.8839      0.00000
     11       4.6949      0.00000
     12       1.6393      0.00000
     13       0.9383      0.00000
     14       2.2467      0.00000
     15       4.3387      0.00000
     16      -2.6687      0.00000
     17       1.1613      0.00000
     18      -4.1997      0.00000
     19      -6.9314      0.00000
     20      -0.9082      0.00000

 k-point 737 :       0.0833   -0.0833   -0.2917
  band No.  band energies     occupation 
      1       0.0035      0.00000
      2       2.5707      0.00000
      3      -3.6674      0.00000
      4       1.3259      0.00000
      5      -5.0536      0.00000
      6       2.9476      0.00000
      7      -0.1550      0.00000
      8       0.8943      0.00000
      9      -9.3596      0.00000
     10      11.3973      0.00000
     11      -1.2321      0.00000
     12       0.1893      0.00000
     13       1.1704      0.00000
     14      -0.5087      0.00000
     15       4.6997      0.00000
     16       6.9874      0.00000
     17      -5.9365      0.00000
     18      -1.5732      0.00000
     19      -8.2365      0.00000
     20       1.3019      0.00000

 k-point 738 :      -0.1667   -0.0833   -0.3750
  band No.  band energies     occupation 
      1       0.0100      0.00000
      2       3.2329      0.00000
      3      -4.5874      0.00000
      4       1.1811      0.00000
      5       0.9539      0.00000
      6      -4.1878      0.00000
      7       1.4726      0.00000
      8      -3.0367      0.00000
      9       4.4567      0.00000
     10       2.2257      0.00000
     11      -0.8906      0.00000
     12       0.7152      0.00000
     13      -1.7709      0.00000
     14       3.1739      0.00000
     15       4.2953      0.00000
     16       2.4776      0.00000
     17      -4.0512      0.00000
     18      -2.3811      0.00000
     19      -3.7810      0.00000
     20      -1.6103      0.00000

 k-point 739 :       0.2083    0.4583    0.2917
  band No.  band energies     occupation 
      1       0.0117      0.00000
      2      -1.9460      0.00000
      3       2.0477      0.00000
      4      -0.1451      0.00000
      5       5.6402      0.00000
      6      -5.0016      0.00000
      7       0.9963      0.00000
      8      -1.2838      0.00000
      9       4.0876      0.00000
     10      -4.9788      0.00000
     11       0.6757      0.00000
     12       1.4304      0.00000
     13      -1.6000      0.00000
     14      -1.6931      0.00000
     15       0.3504      0.00000
     16      -2.1333      0.00000
     17       1.6692      0.00000
     18       1.0821      0.00000
     19       3.1874      0.00000
     20      -1.0648      0.00000

 k-point 740 :       0.2917    0.2083    0.4583
  band No.  band energies     occupation 
      1       0.0121      0.00000
      2      -2.6185      0.00000
      3       3.1559      0.00000
      4      -0.5967      0.00000
      5      -5.1327      0.00000
      6       6.7933      0.00000
      7      -3.9904      0.00000
      8       4.4399      0.00000
      9      -1.6805      0.00000
     10      -1.1912      0.00000
     11       0.7216      0.00000
     12      -0.8301      0.00000
     13       0.7515      0.00000
     14      -3.3381      0.00000
     15       2.5094      0.00000
     16      -0.7921      0.00000
     17      -0.0949      0.00000
     18       1.4939      0.00000
     19       0.9899      0.00000
     20       0.5273      0.00000

 k-point 741 :       0.0833    0.2500   -0.2083
  band No.  band energies     occupation 
      1      -0.0150      0.00000
      2       5.4279      0.00000
      3       1.1219      0.00000
      4      -9.2843      0.00000
      5       6.3242      0.00000
      6      -5.2043      0.00000
      7      -6.6173      0.00000
      8       1.8704      0.00000
      9       7.1862      0.00000
     10      -3.3455      0.00000
     11       1.8229      0.00000
     12       5.4727      0.00000
     13       3.4127      0.00000
     14      -1.8274      0.00000
     15       5.9258      0.00000
     16      -5.8030      0.00000
     17       6.0909      0.00000
     18      -1.4526      0.00000
     19     -12.4278      0.00000
     20      -5.5686      0.00000

 k-point 742 :       0.1667   -0.0833   -0.2917
  band No.  band energies     occupation 
      1      -0.0117      0.00000
      2       1.9460      0.00000
      3      -2.0477      0.00000
      4       0.1451      0.00000
      5      -5.6402      0.00000
      6       5.0016      0.00000
      7      -0.9963      0.00000
      8       1.2838      0.00000
      9      -4.0876      0.00000
     10       4.9788      0.00000
     11      -0.6757      0.00000
     12      -1.4304      0.00000
     13       1.6000      0.00000
     14       1.6931      0.00000
     15      -0.3504      0.00000
     16       2.1333      0.00000
     17      -1.6692      0.00000
     18      -1.0821      0.00000
     19      -3.1874      0.00000
     20       1.0648      0.00000

 k-point 743 :      -0.2500   -0.1667   -0.4583
  band No.  band energies     occupation 
      1      -0.0121      0.00000
      2       2.6185      0.00000
      3      -3.1559      0.00000
      4       0.5967      0.00000
      5       5.1327      0.00000
      6      -6.7933      0.00000
      7       3.9904      0.00000
      8      -4.4399      0.00000
      9       1.6805      0.00000
     10       1.1912      0.00000
     11      -0.7216      0.00000
     12       0.8301      0.00000
     13      -0.7515      0.00000
     14       3.3381      0.00000
     15      -2.5094      0.00000
     16       0.7921      0.00000
     17       0.0949      0.00000
     18      -1.4939      0.00000
     19      -0.9899      0.00000
     20      -0.5273      0.00000

 k-point 744 :       0.2083   -0.4583    0.2917
  band No.  band energies     occupation 
      1      -0.0599      0.00000
      2       1.8872      0.00000
      3      -1.8284      0.00000
      4      -0.0299      0.00000
      5      -1.4494      0.00000
      6       0.8924      0.00000
      7      -2.0911      0.00000
      8       2.1582      0.00000
      9      -0.2885      0.00000
     10       1.3485      0.00000
     11      -0.4992      0.00000
     12      -1.9907      0.00000
     13       2.0540      0.00000
     14       5.0718      0.00000
     15      -1.4194      0.00000
     16      -0.7895      0.00000
     17      -2.6315      0.00000
     18      -3.8058      0.00000
     19       2.0239      0.00000
     20       0.6509      0.00000

 k-point 745 :       0.2917    0.2083   -0.4583
  band No.  band energies     occupation 
      1      -0.0647      0.00000
      2       2.5141      0.00000
      3      -2.9979      0.00000
      4       0.5994      0.00000
      5       2.3312      0.00000
      6      -4.4052      0.00000
      7       7.5414      0.00000
      8      -7.9371      0.00000
      9       1.3576      0.00000
     10       1.7134      0.00000
     11      -0.4306      0.00000
     12       0.5076      0.00000
     13      -0.5410      0.00000
     14       3.7379      0.00000
     15      -0.3785      0.00000
     16      -1.9209      0.00000
     17      -1.0478      0.00000
     18       2.8550      0.00000
     19      -3.6635      0.00000
     20      -2.6946      0.00000

 k-point 746 :       0.0833   -0.6667   -0.2083
  band No.  band energies     occupation 
      1      -0.2417      0.00000
      2       4.8717      0.00000
      3       1.2215      0.00000
      4      -7.9627      0.00000
      5      -6.8069      0.00000
      6       8.2805      0.00000
      7       2.2629      0.00000
      8      -8.8723      0.00000
      9       9.5252      0.00000
     10      -5.5415      0.00000
     11       1.3162      0.00000
     12       3.3309      0.00000
     13       5.1830      0.00000
     14       0.8566      0.00000
     15       4.1660      0.00000
     16      -2.7932      0.00000
     17      12.0133      0.00000
     18     -13.3439      0.00000
     19      -6.0785      0.00000
     20      -4.2982      0.00000

 k-point 747 :      -0.7500   -0.0833   -0.2917
  band No.  band energies     occupation 
      1       0.0599      0.00000
      2      -1.8872      0.00000
      3       1.8284      0.00000
      4       0.0299      0.00000
      5       1.4494      0.00000
      6      -0.8924      0.00000
      7       2.0911      0.00000
      8      -2.1582      0.00000
      9       0.2885      0.00000
     10      -1.3485      0.00000
     11       0.4992      0.00000
     12       1.9907      0.00000
     13      -2.0540      0.00000
     14      -5.0718      0.00000
     15       1.4194      0.00000
     16       0.7895      0.00000
     17       2.6315      0.00000
     18       3.8058      0.00000
     19      -2.0239      0.00000
     20      -0.6509      0.00000

 k-point 748 :       0.6667    0.7500    0.4583
  band No.  band energies     occupation 
      1       0.0647      0.00000
      2      -2.5141      0.00000
      3       2.9979      0.00000
      4      -0.5994      0.00000
      5      -2.3312      0.00000
      6       4.4052      0.00000
      7      -7.5414      0.00000
      8       7.9371      0.00000
      9      -1.3576      0.00000
     10      -1.7134      0.00000
     11       0.4306      0.00000
     12      -0.5076      0.00000
     13       0.5410      0.00000
     14      -3.7379      0.00000
     15       0.3785      0.00000
     16       1.9209      0.00000
     17       1.0478      0.00000
     18      -2.8550      0.00000
     19       3.6635      0.00000
     20       2.6946      0.00000

 k-point 749 :       0.2083   -0.3750    0.2917
  band No.  band energies     occupation 
      1      -0.8331      0.00000
      2       3.2476      0.00000
      3      -2.0870      0.00000
      4      -0.5799      0.00000
      5      -1.0013      0.00000
      6      -0.4339      0.00000
      7       0.0996      0.00000
      8      -4.2297      0.00000
      9       5.4986      0.00000
     10      -0.0605      0.00000
     11       1.2764      0.00000
     12      -3.4128      0.00000
     13       5.5399      0.00000
     14       5.0300      0.00000
     15       2.1990      0.00000
     16      -3.7796      0.00000
     17     -11.7323      0.00000
     18      -0.9324      0.00000
     19       8.6738      0.00000
     20      -2.7094      0.00000

 k-point 750 :       0.2917    0.2083   -0.3750
  band No.  band energies     occupation 
      1      -0.8582      0.00000
      2       3.6912      0.00000
      3      -4.5315      0.00000
      4       1.7919      0.00000
      5       2.6772      0.00000
      6      -8.2623      0.00000
      7      10.0121      0.00000
      8     -10.4201      0.00000
      9       2.7237      0.00000
     10       3.5822      0.00000
     11       1.0709      0.00000
     12       0.5413      0.00000
     13      -0.3326      0.00000
     14       0.0309      0.00000
     15       5.3790      0.00000
     16      -2.8538      0.00000
     17      -2.5704      0.00000
     18      -2.7657      0.00000
     19      -0.9182      0.00000
     20       0.1104      0.00000

 k-point 751 :       0.0833   -0.5833   -0.2083
  band No.  band energies     occupation 
      1      -1.2006      0.00000
      2       3.9351      0.00000
      3       2.8147      0.00000
      4      -6.9674      0.00000
      5      -6.7233      0.00000
      6       8.2857      0.00000
      7       0.1055      0.00000
      8      -4.1656      0.00000
      9       4.9662      0.00000
     10      -6.1694      0.00000
     11       2.3615      0.00000
     12       2.2368      0.00000
     13       1.6197      0.00000
     14       3.1995      0.00000
     15       5.7851      0.00000
     16       1.3948      0.00000
     17       4.0806      0.00000
     18       5.4399      0.00000
     19     -11.6526      0.00000
     20      -3.0276      0.00000

 k-point 752 :      -0.6667   -0.0833   -0.2917
  band No.  band energies     occupation 
      1       0.8331      0.00000
      2      -3.2476      0.00000
      3       2.0870      0.00000
      4       0.5799      0.00000
      5       1.0013      0.00000
      6       0.4339      0.00000
      7      -0.0996      0.00000
      8       4.2297      0.00000
      9      -5.4986      0.00000
     10       0.0605      0.00000
     11      -1.2764      0.00000
     12       3.4128      0.00000
     13      -5.5399      0.00000
     14      -5.0300      0.00000
     15      -2.1990      0.00000
     16       3.7796      0.00000
     17      11.7323      0.00000
     18       0.9324      0.00000
     19      -8.6738      0.00000
     20       2.7094      0.00000

 k-point 753 :       0.5833    0.6667    0.3750
  band No.  band energies     occupation 
      1       0.8582      0.00000
      2      -3.6912      0.00000
      3       4.5315      0.00000
      4      -1.7919      0.00000
      5      -2.6772      0.00000
      6       8.2623      0.00000
      7     -10.0121      0.00000
      8      10.4201      0.00000
      9      -2.7237      0.00000
     10      -3.5822      0.00000
     11      -1.0709      0.00000
     12      -0.5413      0.00000
     13       0.3326      0.00000
     14      -0.0309      0.00000
     15      -5.3790      0.00000
     16       2.8538      0.00000
     17       2.5704      0.00000
     18       2.7657      0.00000
     19       0.9182      0.00000
     20      -0.1104      0.00000

 k-point 754 :       0.2083   -0.2917    0.2917
  band No.  band energies     occupation 
      1      -1.1417      0.00000
      2       4.1275      0.00000
      3      -1.4905      0.00000
      4      -2.1323      0.00000
      5       0.2894      0.00000
      6      -4.2401      0.00000
      7       4.0911      0.00000
      8      -6.7713      0.00000
      9       7.6913      0.00000
     10      -4.4832      0.00000
     11       6.9953      0.00000
     12      -3.4196      0.00000
     13       5.8374      0.00000
     14       2.9665      0.00000
     15       0.5180      0.00000
     16      -3.0013      0.00000
     17       3.9667      0.00000
     18     -13.0912      0.00000
     19      12.2310      0.00000
     20      -7.5611      0.00000

 k-point 755 :       0.2917    0.2083   -0.2917
  band No.  band energies     occupation 
      1      -1.0264      0.00000
      2       4.0920      0.00000
      3      -6.1919      0.00000
      4       3.1695      0.00000
      5       2.3241      0.00000
      6     -10.4136      0.00000
      7       4.3912      0.00000
      8      -0.4332      0.00000
      9       0.1493      0.00000
     10       1.2310      0.00000
     11       6.6645      0.00000
     12      -0.9485      0.00000
     13       2.1171      0.00000
     14      -2.7593      0.00000
     15       2.3436      0.00000
     16       0.5603      0.00000
     17      -4.6637      0.00000
     18      -3.6513      0.00000
     19       7.9392      0.00000
     20      -4.2367      0.00000

 k-point 756 :       0.0833   -0.5000   -0.2083
  band No.  band energies     occupation 
      1      -0.9535      0.00000
      2       2.9489      0.00000
      3       3.3032      0.00000
      4      -6.1007      0.00000
      5      -6.3655      0.00000
      6       8.2999      0.00000
      7      -1.3995      0.00000
      8       3.1540      0.00000
      9      -4.7797      0.00000
     10       0.7113      0.00000
     11      -1.3488      0.00000
     12      -0.0027      0.00000
     13       2.5668      0.00000
     14       4.6301      0.00000
     15       5.8072      0.00000
     16       3.8078      0.00000
     17       0.0136      0.00000
     18      -2.5746      0.00000
     19     -14.2125      0.00000
     20       5.5884      0.00000

 k-point 757 :      -0.5833   -0.0833   -0.2917
  band No.  band energies     occupation 
      1       1.1417      0.00000
      2      -4.1275      0.00000
      3       1.4905      0.00000
      4       2.1323      0.00000
      5      -0.2894      0.00000
      6       4.2401      0.00000
      7      -4.0911      0.00000
      8       6.7713      0.00000
      9      -7.6913      0.00000
     10       4.4832      0.00000
     11      -6.9953      0.00000
     12       3.4196      0.00000
     13      -5.8374      0.00000
     14      -2.9665      0.00000
     15      -0.5180      0.00000
     16       3.0013      0.00000
     17      -3.9667      0.00000
     18      13.0912      0.00000
     19     -12.2310      0.00000
     20       7.5611      0.00000

 k-point 758 :       0.5000    0.5833    0.2917
  band No.  band energies     occupation 
      1       1.0264      0.00000
      2      -4.0920      0.00000
      3       6.1919      0.00000
      4      -3.1695      0.00000
      5      -2.3241      0.00000
      6      10.4136      0.00000
      7      -4.3912      0.00000
      8       0.4332      0.00000
      9      -0.1493      0.00000
     10      -1.2310      0.00000
     11      -6.6645      0.00000
     12       0.9485      0.00000
     13      -2.1171      0.00000
     14       2.7593      0.00000
     15      -2.3436      0.00000
     16      -0.5603      0.00000
     17       4.6637      0.00000
     18       3.6513      0.00000
     19      -7.9392      0.00000
     20       4.2367      0.00000

 k-point 759 :       0.2083   -0.2083    0.2917
  band No.  band energies     occupation 
      1      -0.1965      0.00000
      2       4.3397      0.00000
      3       0.2183      0.00000
      4      -5.4906      0.00000
      5       2.1482      0.00000
      6      -6.2322      0.00000
      7       3.6861      0.00000
      8      -4.3979      0.00000
      9       6.2054      0.00000
     10      -3.8724      0.00000
     11       7.4424      0.00000
     12      -0.4667      0.00000
     13       0.8124      0.00000
     14       4.5405      0.00000
     15      -1.3648      0.00000
     16      -3.7530      0.00000
     17       6.4651      0.00000
     18     -12.5740      0.00000
     19       6.3678      0.00000
     20       9.5645      0.00000

 k-point 760 :       0.2917    0.2083   -0.2083
  band No.  band energies     occupation 
      1      -0.1365      0.00000
      2       3.7222      0.00000
      3      -7.6221      0.00000
      4       3.9586      0.00000
      5       1.5763      0.00000
      6      -4.2201      0.00000
      7      -0.0813      0.00000
      8      -0.3900      0.00000
      9      -0.3303      0.00000
     10       1.7795      0.00000
     11       5.2188      0.00000
     12      -0.4891      0.00000
     13       2.5375      0.00000
     14      -1.0039      0.00000
     15      -4.5930      0.00000
     16       1.0006      0.00000
     17       2.6370      0.00000
     18      -2.6169      0.00000
     19      -0.5028      0.00000
     20       5.2583      0.00000

 k-point 761 :       0.0833   -0.4167   -0.2083
  band No.  band energies     occupation 
      1      -0.1083      0.00000
      2       1.6409      0.00000
      3       2.2739      0.00000
      4      -4.1123      0.00000
      5      -5.0216      0.00000
      6       5.3972      0.00000
      7       0.8228      0.00000
      8       1.0745      0.00000
      9      -7.9209      0.00000
     10       6.1264      0.00000
     11      -1.2162      0.00000
     12      -2.4359      0.00000
     13       1.5211      0.00000
     14       7.1475      0.00000
     15       0.6192      0.00000
     16       4.6670      0.00000
     17      -5.3258      0.00000
     18      -5.7935      0.00000
     19      -0.9360      0.00000
     20      -1.5156      0.00000

 k-point 762 :      -0.5000   -0.0833   -0.2917
  band No.  band energies     occupation 
      1       0.1965      0.00000
      2      -4.3397      0.00000
      3      -0.2183      0.00000
      4       5.4906      0.00000
      5      -2.1482      0.00000
      6       6.2322      0.00000
      7      -3.6861      0.00000
      8       4.3979      0.00000
      9      -6.2054      0.00000
     10       3.8724      0.00000
     11      -7.4424      0.00000
     12       0.4667      0.00000
     13      -0.8124      0.00000
     14      -4.5405      0.00000
     15       1.3648      0.00000
     16       3.7530      0.00000
     17      -6.4651      0.00000
     18      12.5740      0.00000
     19      -6.3678      0.00000
     20      -9.5645      0.00000

 k-point 763 :       0.4167    0.5000    0.2083
  band No.  band energies     occupation 
      1       0.1365      0.00000
      2      -3.7222      0.00000
      3       7.6221      0.00000
      4      -3.9586      0.00000
      5      -1.5763      0.00000
      6       4.2201      0.00000
      7       0.0813      0.00000
      8       0.3900      0.00000
      9       0.3303      0.00000
     10      -1.7795      0.00000
     11      -5.2188      0.00000
     12       0.4891      0.00000
     13      -2.5375      0.00000
     14       1.0039      0.00000
     15       4.5930      0.00000
     16      -1.0006      0.00000
     17      -2.6370      0.00000
     18       2.6169      0.00000
     19       0.5028      0.00000
     20      -5.2583      0.00000

 k-point 764 :       0.2083    0.3750    0.3750
  band No.  band energies     occupation 
      1       0.0130      0.00000
      2      -2.2582      0.00000
      3       6.9856      0.00000
      4      -4.8225      0.00000
      5       5.1307      0.00000
      6      -8.5255      0.00000
      7       4.7947      0.00000
      8      -1.5851      0.00000
      9       9.7518      0.00000
     10      -8.8303      0.00000
     11       1.2617      0.00000
     12      -1.5478      0.00000
     13       4.0191      0.00000
     14      -7.5674      0.00000
     15      -7.0657      0.00000
     16      -6.5185      0.00000
     17       9.5798      0.00000
     18       3.0351      0.00000
     19       8.8347      0.00000
     20      -6.1407      0.00000

 k-point 765 :       0.1667    0.1667   -0.2083
  band No.  band energies     occupation 
      1      -0.0010      0.00000
      2       3.5343      0.00000
      3       1.2179      0.00000
      4      -5.8244      0.00000
      5       2.0105      0.00000
      6      -6.0273      0.00000
      7      -1.3879      0.00000
      8       0.6131      0.00000
      9       3.1550      0.00000
     10       0.6691      0.00000
     11      10.0300      0.00000
     12      -4.5535      0.00000
     13       1.4690      0.00000
     14      -3.4498      0.00000
     15       6.4193      0.00000
     16      -1.9242      0.00000
     17       1.2224      0.00000
     18      -2.7571      0.00000
     19      -6.7381      0.00000
     20      -2.2035      0.00000

 k-point 766 :       0.0000   -0.1667   -0.3750
  band No.  band energies     occupation 
      1      -0.0130      0.00000
      2       2.2582      0.00000
      3      -6.9856      0.00000
      4       4.8225      0.00000
      5      -5.1307      0.00000
      6       8.5255      0.00000
      7      -4.7947      0.00000
      8       1.5851      0.00000
      9      -9.7518      0.00000
     10       8.8303      0.00000
     11      -1.2617      0.00000
     12       1.5478      0.00000
     13      -4.0191      0.00000
     14       7.5674      0.00000
     15       7.0657      0.00000
     16       6.5185      0.00000
     17      -9.5798      0.00000
     18      -3.0351      0.00000
     19      -8.8347      0.00000
     20       6.1407      0.00000

 k-point 767 :       0.2083    0.4583    0.3750
  band No.  band energies     occupation 
      1       0.0474      0.00000
      2      -1.9689      0.00000
      3       0.4889      0.00000
      4       1.5567      0.00000
      5       4.9946      0.00000
      6      -5.5751      0.00000
      7       0.8416      0.00000
      8      -1.3571      0.00000
      9       7.9805      0.00000
     10      -6.8917      0.00000
     11       0.3900      0.00000
     12       1.8185      0.00000
     13       0.5687      0.00000
     14      -7.2048      0.00000
     15      -2.1780      0.00000
     16      -4.7070      0.00000
     17       6.1303      0.00000
     18       5.9067      0.00000
     19       2.8816      0.00000
     20       0.7063      0.00000

 k-point 768 :       0.3750    0.2083    0.4583
  band No.  band energies     occupation 
      1       0.0547      0.00000
      2      -3.4508      0.00000
      3       6.7082      0.00000
      4      -3.2020      0.00000
      5      -1.6654      0.00000
      6       6.4826      0.00000
      7      -3.0798      0.00000
      8       2.2796      0.00000
      9      -1.1920      0.00000
     10      -2.0743      0.00000
     11      -2.8152      0.00000
     12      -0.7450      0.00000
     13      -1.8574      0.00000
     14      -0.4820      0.00000
     15       3.2117      0.00000
     16      -0.4661      0.00000
     17      -2.0554      0.00000
     18       3.6961      0.00000
     19       2.9603      0.00000
     20       0.8278      0.00000

 k-point 769 :       0.1667    0.2500   -0.2083
  band No.  band energies     occupation 
      1      -0.0664      0.00000
      2       4.0861      0.00000
      3       2.5267      0.00000
      4      -8.1740      0.00000
      5       2.8876      0.00000
      6      -9.7070      0.00000
      7       7.4580      0.00000
      8      -5.1241      0.00000
      9       5.4979      0.00000
     10      -2.8639      0.00000
     11       5.3121      0.00000
     12       3.2142      0.00000
     13      -1.3793      0.00000
     14       5.9514      0.00000
     15      -1.5573      0.00000
     16      -3.7017      0.00000
     17       5.0016      0.00000
     18     -11.3368      0.00000
     19       1.6044      0.00000
     20      -5.3828      0.00000

 k-point 770 :       0.0833   -0.1667   -0.3750
  band No.  band energies     occupation 
      1      -0.0474      0.00000
      2       1.9689      0.00000
      3      -0.4889      0.00000
      4      -1.5567      0.00000
      5      -4.9946      0.00000
      6       5.5751      0.00000
      7      -0.8416      0.00000
      8       1.3571      0.00000
      9      -7.9805      0.00000
     10       6.8917      0.00000
     11      -0.3900      0.00000
     12      -1.8185      0.00000
     13      -0.5687      0.00000
     14       7.2048      0.00000
     15       2.1780      0.00000
     16       4.7070      0.00000
     17      -6.1303      0.00000
     18      -5.9067      0.00000
     19      -2.8816      0.00000
     20      -0.7063      0.00000

 k-point 771 :      -0.2500   -0.0833   -0.4583
  band No.  band energies     occupation 
      1      -0.0547      0.00000
      2       3.4508      0.00000
      3      -6.7082      0.00000
      4       3.2020      0.00000
      5       1.6654      0.00000
      6      -6.4826      0.00000
      7       3.0798      0.00000
      8      -2.2796      0.00000
      9       1.1920      0.00000
     10       2.0743      0.00000
     11       2.8152      0.00000
     12       0.7450      0.00000
     13       1.8574      0.00000
     14       0.4820      0.00000
     15      -3.2117      0.00000
     16       0.4661      0.00000
     17       2.0554      0.00000
     18      -3.6961      0.00000
     19      -2.9603      0.00000
     20      -0.8278      0.00000

 k-point 772 :       0.2083   -0.4583    0.3750
  band No.  band energies     occupation 
      1       0.0624      0.00000
      2      -1.2862      0.00000
      3       0.6117      0.00000
      4       0.7168      0.00000
      5       4.6253      0.00000
      6      -5.0105      0.00000
      7       0.5788      0.00000
      8      -1.0302      0.00000
      9       2.1690      0.00000
     10      -1.4515      0.00000
     11      -0.1431      0.00000
     12       2.5515      0.00000
     13      -2.5046      0.00000
     14      -5.9641      0.00000
     15       4.8200      0.00000
     16      -1.9022      0.00000
     17       0.2581      0.00000
     18       3.3308      0.00000
     19      -0.4446      0.00000
     20       2.9587      0.00000

 k-point 773 :       0.3750    0.2083   -0.4583
  band No.  band energies     occupation 
      1       0.0732      0.00000
      2      -2.7211      0.00000
      3       3.7969      0.00000
      4      -1.1761      0.00000
      5      -3.5664      0.00000
      6       6.1509      0.00000
      7      -1.9682      0.00000
      8       0.6104      0.00000
      9       0.3925      0.00000
     10      -1.2453      0.00000
     11      -1.0263      0.00000
     12      -0.6894      0.00000
     13       1.1027      0.00000
     14      -4.0256      0.00000
     15       4.2763      0.00000
     16      -0.5792      0.00000
     17      -0.6171      0.00000
     18      -0.1443      0.00000
     19       2.2994      0.00000
     20      -2.2958      0.00000

 k-point 774 :       0.1667   -0.6667   -0.2083
  band No.  band energies     occupation 
      1      -0.2832      0.00000
      2       5.4401      0.00000
      3       0.8592      0.00000
      4      -7.4539      0.00000
      5       3.8747      0.00000
      6      -9.4479      0.00000
      7       6.7494      0.00000
      8      -6.6155      0.00000
      9       9.6175      0.00000
     10      -6.7547      0.00000
     11       5.1658      0.00000
     12       0.0706      0.00000
     13       1.1684      0.00000
     14       6.5368      0.00000
     15       2.0139      0.00000
     16      -4.5716      0.00000
     17       7.7173      0.00000
     18     -15.8675      0.00000
     19      12.6890      0.00000
     20       6.9201      0.00000

 k-point 775 :      -0.8333   -0.1667   -0.3750
  band No.  band energies     occupation 
      1      -0.0624      0.00000
      2       1.2862      0.00000
      3      -0.6117      0.00000
      4      -0.7168      0.00000
      5      -4.6253      0.00000
      6       5.0105      0.00000
      7      -0.5788      0.00000
      8       1.0302      0.00000
      9      -2.1690      0.00000
     10       1.4515      0.00000
     11       0.1431      0.00000
     12      -2.5515      0.00000
     13       2.5046      0.00000
     14       5.9641      0.00000
     15      -4.8200      0.00000
     16       1.9022      0.00000
     17      -0.2581      0.00000
     18      -3.3308      0.00000
     19       0.4446      0.00000
     20      -2.9587      0.00000

 k-point 776 :       0.6667    0.8333    0.4583
  band No.  band energies     occupation 
      1      -0.0732      0.00000
      2       2.7211      0.00000
      3      -3.7969      0.00000
      4       1.1761      0.00000
      5       3.5664      0.00000
      6      -6.1509      0.00000
      7       1.9682      0.00000
      8      -0.6104      0.00000
      9      -0.3925      0.00000
     10       1.2453      0.00000
     11       1.0263      0.00000
     12       0.6894      0.00000
     13      -1.1027      0.00000
     14       4.0256      0.00000
     15      -4.2763      0.00000
     16       0.5792      0.00000
     17       0.6171      0.00000
     18       0.1443      0.00000
     19      -2.2994      0.00000
     20       2.2958      0.00000

 k-point 777 :       0.2083   -0.3750    0.3750
  band No.  band energies     occupation 
      1      -0.2597      0.00000
      2       1.5903      0.00000
      3      -0.5598      0.00000
      4      -0.9160      0.00000
      5      -5.2077      0.00000
      6       5.3479      0.00000
      7      -0.6115      0.00000
      8       1.0443      0.00000
      9      -0.7087      0.00000
     10      -0.1771      0.00000
     11       0.9182      0.00000
     12      -2.1129      0.00000
     13       1.4038      0.00000
     14       7.6880      0.00000
     15      -5.7879      0.00000
     16       0.7336      0.00000
     17      -1.5571      0.00000
     18       7.8266      0.00000
     19      -9.2812      0.00000
     20       1.9321      0.00000

 k-point 778 :       0.3750    0.2083   -0.3750
  band No.  band energies     occupation 
      1      -0.2750      0.00000
      2       2.7710      0.00000
      3      -3.6433      0.00000
      4       1.1770      0.00000
      5       7.5998      0.00000
      6     -11.1845      0.00000
      7       3.0062      0.00000
      8       0.4891      0.00000
      9      -1.6610      0.00000
     10       1.2268      0.00000
     11       1.4016      0.00000
     12       0.3430      0.00000
     13      -1.6828      0.00000
     14       1.4686      0.00000
     15      -0.2798      0.00000
     16       0.1718      0.00000
     17      -0.3362      0.00000
     18       1.6795      0.00000
     19      -0.3339      0.00000
     20      -1.3103      0.00000

 k-point 779 :       0.1667   -0.5833   -0.2083
  band No.  band energies     occupation 
      1      -1.0020      0.00000
      2       5.0949      0.00000
      3       1.4310      0.00000
      4      -6.5224      0.00000
      5      -8.3748      0.00000
      6       5.7977      0.00000
      7       4.3105      0.00000
      8      -5.0070      0.00000
      9       6.9825      0.00000
     10      -7.1229      0.00000
     11       5.5530      0.00000
     12      -2.5119      0.00000
     13       0.6910      0.00000
     14       4.8319      0.00000
     15       6.7472      0.00000
     16      -2.0819      0.00000
     17       7.0571      0.00000
     18     -11.3592      0.00000
     19       4.0340      0.00000
     20      -2.5871      0.00000

 k-point 780 :      -0.7500   -0.1667   -0.3750
  band No.  band energies     occupation 
      1       0.2597      0.00000
      2      -1.5903      0.00000
      3       0.5598      0.00000
      4       0.9160      0.00000
      5       5.2077      0.00000
      6      -5.3479      0.00000
      7       0.6115      0.00000
      8      -1.0443      0.00000
      9       0.7087      0.00000
     10       0.1771      0.00000
     11      -0.9182      0.00000
     12       2.1129      0.00000
     13      -1.4038      0.00000
     14      -7.6880      0.00000
     15       5.7879      0.00000
     16      -0.7336      0.00000
     17       1.5571      0.00000
     18      -7.8266      0.00000
     19       9.2812      0.00000
     20      -1.9321      0.00000

 k-point 781 :       0.5833    0.7500    0.3750
  band No.  band energies     occupation 
      1       0.2750      0.00000
      2      -2.7710      0.00000
      3       3.6433      0.00000
      4      -1.1770      0.00000
      5      -7.5998      0.00000
      6      11.1845      0.00000
      7      -3.0062      0.00000
      8      -0.4891      0.00000
      9       1.6610      0.00000
     10      -1.2268      0.00000
     11      -1.4016      0.00000
     12      -0.3430      0.00000
     13       1.6828      0.00000
     14      -1.4686      0.00000
     15       0.2798      0.00000
     16      -0.1718      0.00000
     17       0.3362      0.00000
     18      -1.6795      0.00000
     19       0.3339      0.00000
     20       1.3103      0.00000

 k-point 782 :       0.2083   -0.2917    0.3750
  band No.  band energies     occupation 
      1      -2.0106      0.00000
      2       4.8481      0.00000
      3       0.2750      0.00000
      4      -3.6245      0.00000
      5      -2.4511      0.00000
      6       0.0135      0.00000
      7       4.0112      0.00000
      8      -3.1901      0.00000
      9       3.6538      0.00000
     10      -4.3105      0.00000
     11       5.2561      0.00000
     12      -4.1823      0.00000
     13      -0.9281      0.00000
     14       8.9308      0.00000
     15       1.2110      0.00000
     16       1.1306      0.00000
     17      -0.0499      0.00000
     18      -0.3938      0.00000
     19     -12.6407      0.00000
     20      10.2430      0.00000

 k-point 783 :       0.3750    0.2083   -0.2917
  band No.  band energies     occupation 
      1      -1.5560      0.00000
      2       4.8802      0.00000
      3      -6.3421      0.00000
      4       3.0665      0.00000
      5       6.1585      0.00000
      6     -13.8181      0.00000
      7       6.3443      0.00000
      8       1.7090      0.00000
      9      -3.9823      0.00000
     10       2.3057      0.00000
     11       3.9679      0.00000
     12      -0.4176      0.00000
     13      -2.9872      0.00000
     14      -0.4687      0.00000
     15       3.6097      0.00000
     16       2.4002      0.00000
     17      -7.1967      0.00000
     18       8.1193      0.00000
     19      -2.8981      0.00000
     20      -1.2476      0.00000

 k-point 784 :       0.1667   -0.5000   -0.2083
  band No.  band energies     occupation 
      1      -1.7938      0.00000
      2       3.9181      0.00000
      3       2.3684      0.00000
      4      -5.0384      0.00000
      5      -8.0908      0.00000
      6       9.0521      0.00000
      7      -1.4393      0.00000
      8       1.9194      0.00000
      9      -0.6710      0.00000
     10      -2.4547      0.00000
     11       3.4923      0.00000
     12      -3.6291      0.00000
     13       1.2213      0.00000
     14       6.7337      0.00000
     15       1.4401      0.00000
     16       1.2195      0.00000
     17      -3.1836      0.00000
     18       5.9879      0.00000
     19      -0.6710      0.00000
     20      -6.8221      0.00000

 k-point 785 :      -0.6667   -0.1667   -0.3750
  band No.  band energies     occupation 
      1       2.0106      0.00000
      2      -4.8481      0.00000
      3      -0.2750      0.00000
      4       3.6245      0.00000
      5       2.4511      0.00000
      6      -0.0135      0.00000
      7      -4.0112      0.00000
      8       3.1901      0.00000
      9      -3.6538      0.00000
     10       4.3105      0.00000
     11      -5.2561      0.00000
     12       4.1823      0.00000
     13       0.9281      0.00000
     14      -8.9308      0.00000
     15      -1.2110      0.00000
     16      -1.1306      0.00000
     17       0.0499      0.00000
     18       0.3938      0.00000
     19      12.6407      0.00000
     20     -10.2430      0.00000

 k-point 786 :       0.5000    0.6667    0.2917
  band No.  band energies     occupation 
      1       1.5560      0.00000
      2      -4.8802      0.00000
      3       6.3421      0.00000
      4      -3.0665      0.00000
      5      -6.1585      0.00000
      6      13.8181      0.00000
      7      -6.3443      0.00000
      8      -1.7090      0.00000
      9       3.9823      0.00000
     10      -2.3057      0.00000
     11      -3.9679      0.00000
     12       0.4176      0.00000
     13       2.9872      0.00000
     14       0.4687      0.00000
     15      -3.6097      0.00000
     16      -2.4002      0.00000
     17       7.1967      0.00000
     18      -8.1193      0.00000
     19       2.8981      0.00000
     20       1.2476      0.00000

 k-point 787 :       0.2083   -0.2083    0.3750
  band No.  band energies     occupation 
      1      -0.5905      0.00000
      2       5.4306      0.00000
      3       0.5882      0.00000
      4      -6.3671      0.00000
      5       3.1738      0.00000
      6      -8.3496      0.00000
      7       5.7435      0.00000
      8      -5.6672      0.00000
      9       9.6368      0.00000
     10      -7.5073      0.00000
     11       7.2381      0.00000
     12      -3.1664      0.00000
     13      -1.6579      0.00000
     14       8.3852      0.00000
     15       2.9081      0.00000
     16      -3.7881      0.00000
     17      -3.8413      0.00000
     18      -0.8354      0.00000
     19      11.9148      0.00000
     20      -6.8742      0.00000

 k-point 788 :       0.3750    0.2083   -0.2083
  band No.  band energies     occupation 
      1      -0.1510      0.00000
      2       2.5874      0.00000
      3      -4.1531      0.00000
      4       1.7339      0.00000
      5       2.9240      0.00000
      6      -4.9893      0.00000
      7       1.2411      0.00000
      8       0.4970      0.00000
      9      -1.4977      0.00000
     10       1.1897      0.00000
     11       1.8095      0.00000
     12       0.0994      0.00000
     13      -1.5219      0.00000
     14       3.0015      0.00000
     15      -3.2809      0.00000
     16       0.9533      0.00000
     17      -0.2911      0.00000
     18      -0.3445      0.00000
     19       1.5450      0.00000
     20       0.5002      0.00000

 k-point 789 :       0.1667   -0.4167   -0.2083
  band No.  band energies     occupation 
      1      -0.1317      0.00000
      2       0.9128      0.00000
      3       0.7654      0.00000
      4      -1.6974      0.00000
      5      -4.8264      0.00000
      6       5.4025      0.00000
      7      -0.3753      0.00000
      8       1.0690      0.00000
      9      -2.3732      0.00000
     10       1.0741      0.00000
     11       0.3801      0.00000
     12      -2.0620      0.00000
     13       1.9325      0.00000
     14       5.7048      0.00000
     15      -4.9205      0.00000
     16       1.4835      0.00000
     17      -0.1013      0.00000
     18       1.7764      0.00000
     19      -3.5447      0.00000
     20       0.0767      0.00000

 k-point 790 :      -0.5833   -0.1667   -0.3750
  band No.  band energies     occupation 
      1       0.5905      0.00000
      2      -5.4306      0.00000
      3      -0.5882      0.00000
      4       6.3671      0.00000
      5      -3.1738      0.00000
      6       8.3496      0.00000
      7      -5.7435      0.00000
      8       5.6672      0.00000
      9      -9.6368      0.00000
     10       7.5073      0.00000
     11      -7.2381      0.00000
     12       3.1664      0.00000
     13       1.6579      0.00000
     14      -8.3852      0.00000
     15      -2.9081      0.00000
     16       3.7881      0.00000
     17       3.8413      0.00000
     18       0.8354      0.00000
     19     -11.9148      0.00000
     20       6.8742      0.00000

 k-point 791 :       0.4167    0.5833    0.2083
  band No.  band energies     occupation 
      1       0.1510      0.00000
      2      -2.5874      0.00000
      3       4.1531      0.00000
      4      -1.7339      0.00000
      5      -2.9240      0.00000
      6       4.9893      0.00000
      7      -1.2411      0.00000
      8      -0.4970      0.00000
      9       1.4977      0.00000
     10      -1.1897      0.00000
     11      -1.8095      0.00000
     12      -0.0994      0.00000
     13       1.5219      0.00000
     14      -3.0015      0.00000
     15       3.2809      0.00000
     16      -0.9533      0.00000
     17       0.2911      0.00000
     18       0.3445      0.00000
     19      -1.5450      0.00000
     20      -0.5002      0.00000

 k-point 792 :       0.2083    0.4583    0.4583
  band No.  band energies     occupation 
      1       0.1163      0.00000
      2      -1.6612      0.00000
      3      -4.1284      0.00000
      4       6.0861      0.00000
      5       5.0067      0.00000
      6      -4.4753      0.00000
      7      -9.1529      0.00000
      8       5.8933      0.00000
      9      10.3446      0.00000
     10      -8.5072      0.00000
     11       5.2975      0.00000
     12      -2.7754      0.00000
     13       0.7113      0.00000
     14      -6.9484      0.00000
     15      -7.7945      0.00000
     16      -3.6017      0.00000
     17       9.9957      0.00000
     18       6.4577      0.00000
     19       1.3448      0.00000
     20      -2.2777      0.00000

 k-point 793 :       0.2500    0.2500   -0.2083
  band No.  band energies     occupation 
      1      -0.1623      0.00000
      2       3.9609      0.00000
      3      -5.0966      0.00000
      4       0.7560      0.00000
      5       1.3907      0.00000
      6      -2.7544      0.00000
      7      -5.2045      0.00000
      8       2.3883      0.00000
      9       1.9638      0.00000
     10      -0.2591      0.00000
     11       9.4047      0.00000
     12      -2.6989      0.00000
     13       2.6562      0.00000
     14       0.1003      0.00000
     15      -4.7388      0.00000
     16      -0.5310      0.00000
     17       5.7708      0.00000
     18      -7.5301      0.00000
     19       2.3098      0.00000
     20       5.1786      0.00000

 k-point 794 :       0.0000   -0.2500   -0.4583
  band No.  band energies     occupation 
      1      -0.1163      0.00000
      2       1.6612      0.00000
      3       4.1284      0.00000
      4      -6.0861      0.00000
      5      -5.0067      0.00000
      6       4.4753      0.00000
      7       9.1529      0.00000
      8      -5.8933      0.00000
      9     -10.3446      0.00000
     10       8.5072      0.00000
     11      -5.2975      0.00000
     12       2.7754      0.00000
     13      -0.7113      0.00000
     14       6.9484      0.00000
     15       7.7945      0.00000
     16       3.6017      0.00000
     17      -9.9957      0.00000
     18      -6.4577      0.00000
     19      -1.3448      0.00000
     20       2.2777      0.00000

 k-point 795 :       0.2083   -0.4583    0.4583
  band No.  band energies     occupation 
      1       0.2325      0.00000
      2      -1.2394      0.00000
      3      -3.9396      0.00000
      4       5.3930      0.00000
      5       5.0702      0.00000
      6      -5.1090      0.00000
      7      -2.2680      0.00000
      8      -1.1786      0.00000
      9       8.4654      0.00000
     10      -6.0238      0.00000
     11       3.0804      0.00000
     12       0.7724      0.00000
     13      -2.6193      0.00000
     14      -5.2661      0.00000
     15      -0.0306      0.00000
     16      -3.4795      0.00000
     17      -0.7268      0.00000
     18       5.0970      0.00000
     19       4.9082      0.00000
     20      -3.1729      0.00000

 k-point 796 :       0.4583    0.2083   -0.4583
  band No.  band energies     occupation 
      1       0.2911      0.00000
      2      -3.9765      0.00000
      3       6.5932      0.00000
      4      -2.8616      0.00000
      5      -1.2905      0.00000
      6       2.6227      0.00000
      7       1.5464      0.00000
      8      -1.0599      0.00000
      9       1.8334      0.00000
     10      -1.7413      0.00000
     11      -5.7837      0.00000
     12       1.0337      0.00000
     13      -3.0239      0.00000
     14       2.7991      0.00000
     15       4.6029      0.00000
     16      -1.7029      0.00000
     17       3.3580      0.00000
     18      -3.7420      0.00000
     19      -1.7735      0.00000
     20      -1.9868      0.00000

 k-point 797 :       0.2500   -0.6667   -0.2083
  band No.  band energies     occupation 
      1      -0.4328      0.00000
      2       4.6467      0.00000
      3      -2.3560      0.00000
      4      -2.5851      0.00000
      5       1.5238      0.00000
      6      -3.4409      0.00000
      7       1.3719      0.00000
      8      -4.2378      0.00000
      9       6.3859      0.00000
     10      -4.2165      0.00000
     11       7.7926      0.00000
     12      -2.8851      0.00000
     13       3.5053      0.00000
     14       1.2125      0.00000
     15       0.2427      0.00000
     16      -3.6572      0.00000
     17     -10.7982      0.00000
     18       8.8869      0.00000
     19       4.6906      0.00000
     20      -0.2149      0.00000

 k-point 798 :      -0.9167   -0.2500   -0.4583
  band No.  band energies     occupation 
      1      -0.2325      0.00000
      2       1.2394      0.00000
      3       3.9396      0.00000
      4      -5.3930      0.00000
      5      -5.0702      0.00000
      6       5.1090      0.00000
      7       2.2680      0.00000
      8       1.1786      0.00000
      9      -8.4654      0.00000
     10       6.0238      0.00000
     11      -3.0804      0.00000
     12      -0.7724      0.00000
     13       2.6193      0.00000
     14       5.2661      0.00000
     15       0.0306      0.00000
     16       3.4795      0.00000
     17       0.7268      0.00000
     18      -5.0970      0.00000
     19      -4.9082      0.00000
     20       3.1729      0.00000

 k-point 799 :       0.6667    0.9167    0.4583
  band No.  band energies     occupation 
      1      -0.2911      0.00000
      2       3.9765      0.00000
      3      -6.5932      0.00000
      4       2.8616      0.00000
      5       1.2905      0.00000
      6      -2.6227      0.00000
      7      -1.5464      0.00000
      8       1.0598      0.00000
      9      -1.8334      0.00000
     10       1.7413      0.00000
     11       5.7837      0.00000
     12      -1.0337      0.00000
     13       3.0239      0.00000
     14      -2.7991      0.00000
     15      -4.6029      0.00000
     16       1.7029      0.00000
     17      -3.3580      0.00000
     18       3.7420      0.00000
     19       1.7735      0.00000
     20       1.9868      0.00000

 k-point 800 :       0.2083   -0.3750    0.4583
  band No.  band energies     occupation 
      1       0.3056      0.00000
      2      -0.6870      0.00000
      3      -2.8751      0.00000
      4       3.4376      0.00000
      5       5.3764      0.00000
      6      -5.7338      0.00000
      7      -0.2430      0.00000
      8      -0.6636      0.00000
      9       2.4258      0.00000
     10      -1.0466      0.00000
     11      -0.5289      0.00000
     12       1.4038      0.00000
     13      -0.7787      0.00000
     14      -5.5427      0.00000
     15       5.0812      0.00000
     16      -1.0741      0.00000
     17       0.0559      0.00000
     18      -7.7552      0.00000
     19       4.1245      0.00000
     20       3.9330      0.00000

 k-point 801 :       0.4583    0.2083   -0.3750
  band No.  band energies     occupation 
      1       0.3069      0.00000
      2      -2.0560      0.00000
      3       3.8299      0.00000
      4      -2.0882      0.00000
      5      -2.0866      0.00000
      6       3.1000      0.00000
      7      -0.1772      0.00000
      8      -0.9718      0.00000
      9       2.0274      0.00000
     10      -1.4376      0.00000
     11      -2.0202      0.00000
     12       0.6208      0.00000
     13       1.7720      0.00000
     14      -2.5705      0.00000
     15       2.9204      0.00000
     16      -1.7240      0.00000
     17       1.3445      0.00000
     18      -6.7365      0.00000
     19       5.4352      0.00000
     20      -1.5804      0.00000

 k-point 802 :       0.2500   -0.5833   -0.2083
  band No.  band energies     occupation 
      1      -1.1299      0.00000
      2       4.8480      0.00000
      3       0.1518      0.00000
      4      -4.3943      0.00000
      5       2.3085      0.00000
      6      -5.0871      0.00000
      7       3.3786      0.00000
      8      -3.6379      0.00000
      9       7.9413      0.00000
     10      -7.1952      0.00000
     11       7.7819      0.00000
     12      -4.9777      0.00000
     13      -3.9342      0.00000
     14       7.7081      0.00000
     15       2.4849      0.00000
     16       0.4129      0.00000
     17       5.5764      0.00000
     18     -10.9044      0.00000
     19      -6.9306      0.00000
     20      12.5730      0.00000

 k-point 803 :      -0.8333   -0.2500   -0.4583
  band No.  band energies     occupation 
      1      -0.3056      0.00000
      2       0.6870      0.00000
      3       2.8751      0.00000
      4      -3.4376      0.00000
      5      -5.3764      0.00000
      6       5.7338      0.00000
      7       0.2430      0.00000
      8       0.6636      0.00000
      9      -2.4258      0.00000
     10       1.0466      0.00000
     11       0.5289      0.00000
     12      -1.4038      0.00000
     13       0.7787      0.00000
     14       5.5427      0.00000
     15      -5.0812      0.00000
     16       1.0741      0.00000
     17      -0.0559      0.00000
     18       7.7552      0.00000
     19      -4.1245      0.00000
     20      -3.9330      0.00000

 k-point 804 :       0.5833    0.8333    0.3750
  band No.  band energies     occupation 
      1      -0.3069      0.00000
      2       2.0560      0.00000
      3      -3.8299      0.00000
      4       2.0882      0.00000
      5       2.0866      0.00000
      6      -3.1000      0.00000
      7       0.1772      0.00000
      8       0.9717      0.00000
      9      -2.0274      0.00000
     10       1.4376      0.00000
     11       2.0202      0.00000
     12      -0.6208      0.00000
     13      -1.7720      0.00000
     14       2.5705      0.00000
     15      -2.9204      0.00000
     16       1.7240      0.00000
     17      -1.3445      0.00000
     18       6.7365      0.00000
     19      -5.4352      0.00000
     20       1.5804      0.00000

 k-point 805 :       0.2083   -0.2917    0.4583
  band No.  band energies     occupation 
      1      -2.0787      0.00000
      2       2.8605      0.00000
      3       3.4979      0.00000
      4      -4.4694      0.00000
      5      -8.4569      0.00000
      6       9.9072      0.00000
      7      -1.2782      0.00000
      8       0.3518      0.00000
      9       0.4908      0.00000
     10      -1.6994      0.00000
     11       3.2064      0.00000
     12      -3.0887      0.00000
     13      -2.3554      0.00000
     14       7.4242      0.00000
     15       1.8390      0.00000
     16      -3.5733      0.00000
     17       1.4747      0.00000
     18      -1.1513      0.00000
     19       4.2382      0.00000
     20      -7.9934      0.00000

 k-point 806 :       0.4583    0.2083   -0.2917
  band No.  band energies     occupation 
      1      -0.9289      0.00000
      2       1.8008      0.00000
      3      -2.2887      0.00000
      4       1.4211      0.00000
      5       3.1652      0.00000
      6      -5.4120      0.00000
      7       2.8735      0.00000
      8      -0.5412      0.00000
      9      -1.4008      0.00000
     10       1.1562      0.00000
     11       1.1046      0.00000
     12      -0.5860      0.00000
     13      -1.4685      0.00000
     14       1.4828      0.00000
     15       0.8462      0.00000
     16      -0.9682      0.00000
     17      -1.9853      0.00000
     18       2.2931      0.00000
     19       2.5333      0.00000
     20      -1.7746      0.00000

 k-point 807 :       0.2500   -0.5000   -0.2083
  band No.  band energies     occupation 
      1      -2.5541      0.00000
      2       3.9318      0.00000
      3       1.3482      0.00000
      4      -2.9083      0.00000
      5      -1.4198      0.00000
      6      -0.5186      0.00000
      7       4.7191      0.00000
      8      -2.9840      0.00000
      9       3.0299      0.00000
     10      -3.6600      0.00000
     11       4.3000      0.00000
     12      -3.7036      0.00000
     13      -3.5195      0.00000
     14       1.6241      0.00000
     15       6.7810      0.00000
     16       2.6250      0.00000
     17      -1.7383      0.00000
     18      -2.2989      0.00000
     19     -13.3274      0.00000
     20      14.4563      0.00000

 k-point 808 :      -0.7500   -0.2500   -0.4583
  band No.  band energies     occupation 
      1       2.0787      0.00000
      2      -2.8605      0.00000
      3      -3.4979      0.00000
      4       4.4694      0.00000
      5       8.4569      0.00000
      6      -9.9072      0.00000
      7       1.2782      0.00000
      8      -0.3518      0.00000
      9      -0.4908      0.00000
     10       1.6994      0.00000
     11      -3.2064      0.00000
     12       3.0887      0.00000
     13       2.3554      0.00000
     14      -7.4242      0.00000
     15      -1.8390      0.00000
     16       3.5733      0.00000
     17      -1.4747      0.00000
     18       1.1513      0.00000
     19      -4.2382      0.00000
     20       7.9934      0.00000

 k-point 809 :       0.5000    0.7500    0.2917
  band No.  band energies     occupation 
      1       0.9289      0.00000
      2      -1.8008      0.00000
      3       2.2887      0.00000
      4      -1.4211      0.00000
      5      -3.1652      0.00000
      6       5.4120      0.00000
      7      -2.8735      0.00000
      8       0.5412      0.00000
      9       1.4008      0.00000
     10      -1.1562      0.00000
     11      -1.1046      0.00000
     12       0.5860      0.00000
     13       1.4685      0.00000
     14      -1.4828      0.00000
     15      -0.8462      0.00000
     16       0.9682      0.00000
     17       1.9853      0.00000
     18      -2.2931      0.00000
     19      -2.5333      0.00000
     20       1.7746      0.00000

 k-point 810 :       0.2083   -0.2083    0.4583
  band No.  band energies     occupation 
      1      -1.8132      0.00000
      2       5.1100      0.00000
      3       1.7006      0.00000
      4      -5.5608      0.00000
      5      -5.4794      0.00000
      6       2.0184      0.00000
      7       5.1551      0.00000
      8      -2.7111      0.00000
      9       4.6030      0.00000
     10      -5.9748      0.00000
     11       6.2621      0.00000
     12      -4.4801      0.00000
     13      -2.4098      0.00000
     14       6.1861      0.00000
     15       5.7802      0.00000
     16       1.8869      0.00000
     17       3.2725      0.00000
     18      -5.2141      0.00000
     19     -17.0148      0.00000
     20      13.0250      0.00000

 k-point 811 :       0.4583    0.2083   -0.2083
  band No.  band energies     occupation 
      1       0.5606      0.00000
      2      -2.6408      0.00000
      3       3.7472      0.00000
      4      -1.6850      0.00000
      5      -8.6716      0.00000
      6      12.9404      0.00000
      7      -3.8738      0.00000
      8      -0.5947      0.00000
      9       2.0193      0.00000
     10      -1.3283      0.00000
     11      -1.7009      0.00000
     12       0.3079      0.00000
     13       1.8132      0.00000
     14      -1.2539      0.00000
     15       0.7356      0.00000
     16      -1.4912      0.00000
     17       2.4547      0.00000
     18      -3.1098      0.00000
     19      -1.2563      0.00000
     20       2.1949      0.00000

 k-point 812 :       0.2500   -0.4167   -0.2083
  band No.  band energies     occupation 
      1       0.6158      0.00000
      2      -1.6398      0.00000
      3      -0.8440      0.00000
      4       2.0451      0.00000
      5       8.3294      0.00000
      6      -9.1530      0.00000
      7       0.8993      0.00000
      8      -0.6227      0.00000
      9       0.3160      0.00000
     10       0.7774      0.00000
     11      -1.6895      0.00000
     12       2.0411      0.00000
     13      -0.0048      0.00000
     14      -7.8126      0.00000
     15       5.7691      0.00000
     16      -0.9952      0.00000
     17       0.4900      0.00000
     18      -3.0545      0.00000
     19       2.1098      0.00000
     20       0.4807      0.00000

 k-point 813 :      -0.6667   -0.2500   -0.4583
  band No.  band energies     occupation 
      1       1.8132      0.00000
      2      -5.1100      0.00000
      3      -1.7006      0.00000
      4       5.5608      0.00000
      5       5.4794      0.00000
      6      -2.0184      0.00000
      7      -5.1551      0.00000
      8       2.7111      0.00000
      9      -4.6030      0.00000
     10       5.9748      0.00000
     11      -6.2621      0.00000
     12       4.4801      0.00000
     13       2.4098      0.00000
     14      -6.1861      0.00000
     15      -5.7802      0.00000
     16      -1.8869      0.00000
     17      -3.2725      0.00000
     18       5.2141      0.00000
     19      17.0148      0.00000
     20     -13.0250      0.00000

 k-point 814 :       0.4167    0.6667    0.2083
  band No.  band energies     occupation 
      1      -0.5606      0.00000
      2       2.6408      0.00000
      3      -3.7472      0.00000
      4       1.6850      0.00000
      5       8.6716      0.00000
      6     -12.9404      0.00000
      7       3.8738      0.00000
      8       0.5947      0.00000
      9      -2.0193      0.00000
     10       1.3283      0.00000
     11       1.7009      0.00000
     12      -0.3079      0.00000
     13      -1.8132      0.00000
     14       1.2539      0.00000
     15      -0.7356      0.00000
     16       1.4912      0.00000
     17      -2.4547      0.00000
     18       3.1098      0.00000
     19       1.2563      0.00000
     20      -2.1949      0.00000

 k-point 815 :       0.2083   -0.4583   -0.4583
  band No.  band energies     occupation 
      1       0.5775      0.00000
      2      -0.9550      0.00000
      3      -4.5529      0.00000
      4       5.6549      0.00000
      5       4.8571      0.00000
      6      -4.7143      0.00000
      7     -10.6403      0.00000
      8       4.7618      0.00000
      9      11.4362      0.00000
     10      -9.7922      0.00000
     11       8.1308      0.00000
     12      -3.0655      0.00000
     13      -1.7208      0.00000
     14      -4.3459      0.00000
     15       9.6731      0.00000
     16      -3.3917      0.00000
     17     -11.3478      0.00000
     18      -0.6562      0.00000
     19      11.1169      0.00000
     20      -4.3371      0.00000

 k-point 816 :      -0.6667   -0.6667   -0.2083
  band No.  band energies     occupation 
      1      -0.7202      0.00000
      2       4.1033      0.00000
      3      -3.8887      0.00000
      4       0.3169      0.00000
      5       0.6411      0.00000
      6      -1.1320      0.00000
      7      -2.9470      0.00000
      8       1.0334      0.00000
      9       0.7023      0.00000
     10      -0.2168      0.00000
     11       4.1994      0.00000
     12      -0.5417      0.00000
     13       4.8724      0.00000
     14      -4.1527      0.00000
     15      -5.9466      0.00000
     16       5.2439      0.00000
     17      -5.4286      0.00000
     18      -0.7595      0.00000
     19       9.7997      0.00000
     20      -2.1862      0.00000

 k-point 817 :       0.0000    0.6667    0.4583
  band No.  band energies     occupation 
      1      -0.5775      0.00000
      2       0.9550      0.00000
      3       4.5529      0.00000
      4      -5.6549      0.00000
      5      -4.8571      0.00000
      6       4.7143      0.00000
      7      10.6403      0.00000
      8      -4.7618      0.00000
      9     -11.4362      0.00000
     10       9.7922      0.00000
     11      -8.1308      0.00000
     12       3.0655      0.00000
     13       1.7208      0.00000
     14       4.3459      0.00000
     15      -9.6731      0.00000
     16       3.3917      0.00000
     17      11.3478      0.00000
     18       0.6562      0.00000
     19     -11.1169      0.00000
     20       4.3371      0.00000

 k-point 818 :       0.2083   -0.3750   -0.4583
  band No.  band energies     occupation 
      1       1.7719      0.00000
      2      -1.8750      0.00000
      3      -4.8043      0.00000
      4       5.4916      0.00000
      5       5.1208      0.00000
      6      -5.1017      0.00000
      7      -6.9810      0.00000
      8       2.2194      0.00000
      9       9.0098      0.00000
     10      -5.5490      0.00000
     11       3.8775      0.00000
     12      -1.4968      0.00000
     13      -4.6243      0.00000
     14      -0.7773      0.00000
     15       3.2060      0.00000
     16       4.3136      0.00000
     17      -5.5514      0.00000
     18      -8.5395      0.00000
     19      -3.7407      0.00000
     20       6.1535      0.00000

 k-point 819 :      -0.4583    0.2083   -0.3750
  band No.  band energies     occupation 
      1       1.0489      0.00000
      2      -2.1998      0.00000
      3       1.6179      0.00000
      4      -0.4590      0.00000
      5      -0.2955      0.00000
      6       0.5030      0.00000
      7       1.7393      0.00000
      8      -2.0086      0.00000
      9       1.3461      0.00000
     10      -0.7915      0.00000
     11      -1.3195      0.00000
     12       0.0475      0.00000
     13      -1.6775      0.00000
     14       3.2268      0.00000
     15      -2.2185      0.00000
     16       1.0381      0.00000
     17       1.8183      0.00000
     18      -8.3150      0.00000
     19       7.9352      0.00000
     20      -3.0336      0.00000

 k-point 820 :      -0.6667   -0.5833   -0.2083
  band No.  band energies     occupation 
      1      -1.4654      0.00000
      2       2.8392      0.00000
      3      -1.2174      0.00000
      4      -0.2845      0.00000
      5       0.3074      0.00000
      6      -0.5969      0.00000
      7       0.6342      0.00000
      8      -1.8285      0.00000
      9       2.0892      0.00000
     10      -1.3855      0.00000
     11       1.7399      0.00000
     12      -0.5560      0.00000
     13       3.2870      0.00000
     14      -3.2752      0.00000
     15      -6.5137      0.00000
     16       9.1176      0.00000
     17      -1.2846      0.00000
     18      -5.1886      0.00000
     19      -0.2638      0.00000
     20       8.3147      0.00000

 k-point 821 :       0.0833    0.6667    0.4583
  band No.  band energies     occupation 
      1      -1.7719      0.00000
      2       1.8750      0.00000
      3       4.8043      0.00000
      4      -5.4916      0.00000
      5      -5.1208      0.00000
      6       5.1017      0.00000
      7       6.9810      0.00000
      8      -2.2194      0.00000
      9      -9.0098      0.00000
     10       5.5490      0.00000
     11      -3.8775      0.00000
     12       1.4968      0.00000
     13       4.6243      0.00000
     14       0.7773      0.00000
     15      -3.2060      0.00000
     16      -4.3136      0.00000
     17       5.5514      0.00000
     18       8.5395      0.00000
     19       3.7407      0.00000
     20      -6.1535      0.00000

 k-point 822 :       0.5833   -0.0833    0.3750
  band No.  band energies     occupation 
      1      -1.0489      0.00000
      2       2.1998      0.00000
      3      -1.6179      0.00000
      4       0.4590      0.00000
      5       0.2955      0.00000
      6      -0.5030      0.00000
      7      -1.7393      0.00000
      8       2.0086      0.00000
      9      -1.3461      0.00000
     10       0.7915      0.00000
     11       1.3195      0.00000
     12      -0.0475      0.00000
     13       1.6775      0.00000
     14      -3.2268      0.00000
     15       2.2185      0.00000
     16      -1.0381      0.00000
     17      -1.8183      0.00000
     18       8.3150      0.00000
     19      -7.9352      0.00000
     20       3.0336      0.00000

 k-point 823 :       0.2083   -0.2917   -0.4583
  band No.  band energies     occupation 
      1       1.1203      0.00000
      2      -1.3165      0.00000
      3      -4.7351      0.00000
      4       5.1282      0.00000
      5       5.9785      0.00000
      6      -6.1858      0.00000
      7      -1.2610      0.00000
      8       0.3226      0.00000
      9       2.8528      0.00000
     10      -1.4421      0.00000
     11      -0.7199      0.00000
     12       1.0844      0.00000
     13       1.2215      0.00000
     14      -6.5383      0.00000
     15       1.0732      0.00000
     16       4.0549      0.00000
     17      -2.4262      0.00000
     18      -0.6763      0.00000
     19      -4.7226      0.00000
     20       5.2727      0.00000

 k-point 824 :      -0.4583    0.2083   -0.2917
  band No.  band energies     occupation 
      1      -0.6010      0.00000
      2       1.2153      0.00000
      3      -1.6485      0.00000
      4       1.0375      0.00000
      5       0.8014      0.00000
      6      -1.0940      0.00000
      7      -0.4304      0.00000
      8       0.8092      0.00000
      9      -1.3901      0.00000
     10       1.1170      0.00000
     11       1.0887      0.00000
     12      -0.5768      0.00000
     13      -1.5752      0.00000
     14       1.5744      0.00000
     15       0.4990      0.00000
     16      -0.9426      0.00000
     17      -0.8397      0.00000
     18       1.5517      0.00000
     19      -0.2959      0.00000
     20       0.2420      0.00000

 k-point 825 :      -0.6667   -0.5000   -0.2083
  band No.  band energies     occupation 
      1       1.9768      0.00000
      2      -3.3837      0.00000
      3       0.0835      0.00000
      4       1.4918      0.00000
      5      -0.8957      0.00000
      6       1.7316      0.00000
      7      -2.0618      0.00000
      8       2.1477      0.00000
      9      -4.6232      0.00000
     10       4.5410      0.00000
     11      -4.1539      0.00000
     12       3.1267      0.00000
     13       2.7514      0.00000
     14      -1.4521      0.00000
     15       0.7217      0.00000
     16      -8.8250      0.00000
     17       2.0419      0.00000
     18       2.4558      0.00000
     19      10.3005      0.00000
     20     -11.2061      0.00000

 k-point 826 :       0.1667    0.6667    0.4583
  band No.  band energies     occupation 
      1      -1.1203      0.00000
      2       1.3165      0.00000
      3       4.7351      0.00000
      4      -5.1282      0.00000
      5      -5.9785      0.00000
      6       6.1858      0.00000
      7       1.2610      0.00000
      8      -0.3226      0.00000
      9      -2.8528      0.00000
     10       1.4421      0.00000
     11       0.7199      0.00000
     12      -1.0844      0.00000
     13      -1.2215      0.00000
     14       6.5383      0.00000
     15      -1.0732      0.00000
     16      -4.0549      0.00000
     17       2.4262      0.00000
     18       0.6763      0.00000
     19       4.7226      0.00000
     20      -5.2727      0.00000

 k-point 827 :       0.5000   -0.1667    0.2917
  band No.  band energies     occupation 
      1       0.6010      0.00000
      2      -1.2153      0.00000
      3       1.6485      0.00000
      4      -1.0375      0.00000
      5      -0.8014      0.00000
      6       1.0940      0.00000
      7       0.4304      0.00000
      8      -0.8092      0.00000
      9       1.3901      0.00000
     10      -1.1170      0.00000
     11      -1.0887      0.00000
     12       0.5768      0.00000
     13       1.5752      0.00000
     14      -1.5744      0.00000
     15      -0.4990      0.00000
     16       0.9426      0.00000
     17       0.8397      0.00000
     18      -1.5517      0.00000
     19       0.2959      0.00000
     20      -0.2420      0.00000

 k-point 828 :       0.2083   -0.3750   -0.3750
  band No.  band energies     occupation 
      1       1.8744      0.00000
      2      -1.9202      0.00000
      3      -4.7428      0.00000
      4       5.5737      0.00000
      5       4.8094      0.00000
      6      -4.7442      0.00000
      7     -11.2299      0.00000
      8       4.0925      0.00000
      9      12.1067      0.00000
     10     -10.2092      0.00000
     11       8.7916      0.00000
     12      -3.1871      0.00000
     13      -3.2206      0.00000
     14      -3.2819      0.00000
     15      11.9384      0.00000
     16      -2.5918      0.00000
     17     -13.3690      0.00000
     18      -0.8296      0.00000
     19      -2.4425      0.00000
     20      -7.6315      0.00000

 k-point 829 :      -0.5833   -0.5833   -0.2083
  band No.  band energies     occupation 
      1       1.2418      0.00000
      2      -2.5601      0.00000
      3       1.4833      0.00000
      4      -0.1051      0.00000
      5      -0.2169      0.00000
      6       0.3798      0.00000
      7       1.0668      0.00000
      8      -0.3692      0.00000
      9      -0.2311      0.00000
     10       0.1260      0.00000
     11      -1.4338      0.00000
     12       0.0723      0.00000
     13      -2.5146      0.00000
     14       3.6380      0.00000
     15       2.8970      0.00000
     16      -4.8631      0.00000
     17       3.5348      0.00000
     18       2.0751      0.00000
     19      -3.5140      0.00000
     20      -3.4853      0.00000

 k-point 830 :       0.0000    0.5833    0.3750
  band No.  band energies     occupation 
      1      -1.8744      0.00000
      2       1.9202      0.00000
      3       4.7428      0.00000
      4      -5.5738      0.00000
      5      -4.8094      0.00000
      6       4.7442      0.00000
      7      11.2299      0.00000
      8      -4.0925      0.00000
      9     -12.1067      0.00000
     10      10.2092      0.00000
     11      -8.7916      0.00000
     12       3.1871      0.00000
     13       3.2206      0.00000
     14       3.2819      0.00000
     15     -11.9384      0.00000
     16       2.5918      0.00000
     17      13.3690      0.00000
     18       0.8296      0.00000
     19       2.4425      0.00000
     20       7.6315      0.00000

 k-point 831 :       0.2083   -0.2917   -0.3750
  band No.  band energies     occupation 
      1       0.5328      0.00000
      2      -0.9376      0.00000
      3      -4.5948      0.00000
      4       5.5383      0.00000
      5       5.1059      0.00000
      6      -5.0887      0.00000
      7      -3.8683      0.00000
      8      -0.5809      0.00000
      9       8.9745      0.00000
     10      -5.8795      0.00000
     11       3.9324      0.00000
     12      -0.8061      0.00000
     13      -3.4191      0.00000
     14      -3.1080      0.00000
     15       4.2747      0.00000
     16      -1.3107      0.00000
     17      -3.1419      0.00000
     18      -4.3235      0.00000
     19       3.7787      0.00000
     20       2.2815      0.00000

 k-point 832 :      -0.3750    0.2083   -0.2917
  band No.  band energies     occupation 
      1      -0.5867      0.00000
      2       3.6373      0.00000
      3      -4.5760      0.00000
      4       1.5022      0.00000
      5       0.8475      0.00000
      6      -1.5219      0.00000
      7      -2.1854      0.00000
      8       2.3926      0.00000
      9      -2.6506      0.00000
     10       1.7054      0.00000
     11       3.8840      0.00000
     12      -0.3819      0.00000
     13       3.2013      0.00000
     14      -4.0215      0.00000
     15      -4.7957      0.00000
     16       2.8996      0.00000
     17       0.7292      0.00000
     18      -3.2828      0.00000
     19       6.8367      0.00000
     20       0.9896      0.00000

 k-point 833 :      -0.5833   -0.5000   -0.2083
  band No.  band energies     occupation 
      1       0.8579      0.00000
      2      -4.3975      0.00000
      3       2.8899      0.00000
      4       1.0534      0.00000
      5      -0.9184      0.00000
      6       1.8569      0.00000
      7      -0.7830      0.00000
      8       3.6811      0.00000
      9      -5.2653      0.00000
     10       3.4622      0.00000
     11      -5.1332      0.00000
     12       1.9089      0.00000
     13      -5.2912      0.00000
     14       2.4035      0.00000
     15       1.0762      0.00000
     16       1.2491      0.00000
     17      -1.5497      0.00000
     18       6.4636      0.00000
     19     -10.4083      0.00000
     20       0.9487      0.00000

 k-point 834 :       0.0833    0.5833    0.3750
  band No.  band energies     occupation 
      1      -0.5328      0.00000
      2       0.9376      0.00000
      3       4.5948      0.00000
      4      -5.5383      0.00000
      5      -5.1059      0.00000
      6       5.0887      0.00000
      7       3.8683      0.00000
      8       0.5809      0.00000
      9      -8.9745      0.00000
     10       5.8795      0.00000
     11      -3.9324      0.00000
     12       0.8061      0.00000
     13       3.4191      0.00000
     14       3.1080      0.00000
     15      -4.2747      0.00000
     16       1.3107      0.00000
     17       3.1419      0.00000
     18       4.3235      0.00000
     19      -3.7787      0.00000
     20      -2.2815      0.00000

 k-point 835 :       0.5000   -0.0833    0.2917
  band No.  band energies     occupation 
      1       0.5867      0.00000
      2      -3.6373      0.00000
      3       4.5760      0.00000
      4      -1.5022      0.00000
      5      -0.8475      0.00000
      6       1.5219      0.00000
      7       2.1854      0.00000
      8      -2.3926      0.00000
      9       2.6506      0.00000
     10      -1.7054      0.00000
     11      -3.8840      0.00000
     12       0.3819      0.00000
     13      -3.2013      0.00000
     14       4.0215      0.00000
     15       4.7957      0.00000
     16      -2.8996      0.00000
     17      -0.7292      0.00000
     18       3.2828      0.00000
     19      -6.8367      0.00000
     20      -0.9896      0.00000

 k-point 836 :       0.2083   -0.2917   -0.2917
  band No.  band energies     occupation 
      1       0.2522      0.00000
      2      -1.2680      0.00000
      3      -4.2058      0.00000
      4       5.8209      0.00000
      5       4.9344      0.00000
      6      -4.6270      0.00000
      7      -9.8474      0.00000
      8       5.3721      0.00000
      9      10.8326      0.00000
     10      -9.1417      0.00000
     11       7.0206      0.00000
     12      -2.9385      0.00000
     13      -0.5740      0.00000
     14      -5.6655      0.00000
     15      -6.4432      0.00000
     16      -3.3558      0.00000
     17       4.6115      0.00000
     18       8.1259      0.00000
     19       2.7502      0.00000
     20      -4.8466      0.00000

 k-point 837 :      -0.5000   -0.5000   -0.2083
  band No.  band energies     occupation 
      1       0.3579      0.00000
      2      -4.3022      0.00000
      3       4.8209      0.00000
      4      -0.5331      0.00000
      5      -1.0382      0.00000
      6       1.8971      0.00000
      7       4.3129      0.00000
      8      -1.6644      0.00000
      9      -1.3130      0.00000
     10       0.3326      0.00000
     11      -6.8685      0.00000
     12       1.5625      0.00000
     13      -4.4178      0.00000
     14       2.3494      0.00000
     15       5.2042      0.00000
     16      -0.8119      0.00000
     17       7.2267      0.00000
     18      -8.0860      0.00000
     19      -2.2873      0.00000
     20       0.3387      0.00000

 k-point 838 :       0.0000    0.5000    0.2917
  band No.  band energies     occupation 
      1      -0.2522      0.00000
      2       1.2680      0.00000
      3       4.2058      0.00000
      4      -5.8209      0.00000
      5      -4.9344      0.00000
      6       4.6270      0.00000
      7       9.8474      0.00000
      8      -5.3721      0.00000
      9     -10.8326      0.00000
     10       9.1417      0.00000
     11      -7.0206      0.00000
     12       2.9385      0.00000
     13       0.5740      0.00000
     14       5.6655      0.00000
     15       6.4432      0.00000
     16       3.3558      0.00000
     17      -4.6115      0.00000
     18      -8.1259      0.00000
     19      -2.7502      0.00000
     20       4.8466      0.00000

 k-point 839 :       0.0000    0.0000   -0.2917
  band No.  band energies     occupation 
      1       0.0303      0.00000
      2       2.9933      0.00000
      3     -10.3020      0.00000
      4       6.4897      0.00000
      5     -13.0424      0.00000
      6      11.3871      0.00000
      7      -1.4473      0.00000
      8      -3.8766      0.00000
      9       5.2828      0.00000
     10      -0.0886      0.00000
     11       9.1173      0.00000
     12      -5.1536      0.00000
     13       0.6195      0.00000
     14       7.7083      0.00000
     15      -6.6757      0.00000
     16       0.5855      0.00000
     17       9.3675      0.00000
     18      -5.9026      0.00000
     19     -10.6525      0.00000
     20      -0.0386      0.00000

 k-point 840 :       0.2917    0.3750    0.2917
  band No.  band energies     occupation 
      1      -0.0036      0.00000
      2      -2.7018      0.00000
      3       4.7022      0.00000
      4      -2.0898      0.00000
      5       6.4337      0.00000
      6      -1.8021      0.00000
      7      -1.1084      0.00000
      8       3.3584      0.00000
      9      -5.4783      0.00000
     10      -5.7245      0.00000
     11       3.8680      0.00000
     12      -0.5237      0.00000
     13       0.7805      0.00000
     14      -2.3668      0.00000
     15      -4.6988      0.00000
     16      -5.5161      0.00000
     17       3.0364      0.00000
     18       3.3071      0.00000
     19       2.6134      0.00000
     20       8.7969      0.00000

 k-point 841 :       0.0000    0.0833   -0.2917
  band No.  band energies     occupation 
      1       0.0252      0.00000
      2       3.1515      0.00000
      3       5.0825      0.00000
      4     -10.8078      0.00000
      5      12.8600      0.00000
      6      -7.9145      0.00000
      7      -7.6810      0.00000
      8      -3.2704      0.00000
      9       6.4126      0.00000
     10      -1.2971      0.00000
     11       6.1968      0.00000
     12       0.5563      0.00000
     13       2.7740      0.00000
     14       3.5197      0.00000
     15      -4.2915      0.00000
     16       2.8710      0.00000
     17       6.4392      0.00000
     18      -7.6044      0.00000
     19      -6.4930      0.00000
     20      -3.7553      0.00000

 k-point 842 :       0.0833   -0.0000   -0.2917
  band No.  band energies     occupation 
      1       0.0036      0.00000
      2       2.7018      0.00000
      3      -4.7022      0.00000
      4       2.0898      0.00000
      5      -6.4337      0.00000
      6       1.8021      0.00000
      7       1.1084      0.00000
      8      -3.3584      0.00000
      9       5.4783      0.00000
     10       5.7245      0.00000
     11      -3.8680      0.00000
     12       0.5237      0.00000
     13      -0.7805      0.00000
     14       2.3668      0.00000
     15       4.6988      0.00000
     16       5.5161      0.00000
     17      -3.0364      0.00000
     18      -3.3071      0.00000
     19      -2.6134      0.00000
     20      -8.7969      0.00000

 k-point 843 :       0.2917    0.4583    0.2917
  band No.  band energies     occupation 
      1       0.0401      0.00000
      2      -2.5947      0.00000
      3       3.5250      0.00000
      4      -1.1581      0.00000
      5      -0.4139      0.00000
      6       4.3978      0.00000
      7      -1.6648      0.00000
      8       3.1366      0.00000
      9      -4.4799      0.00000
     10      -4.0261      0.00000
     11       3.4471      0.00000
     12      -0.1741      0.00000
     13      -0.1995      0.00000
     14      -3.9045      0.00000
     15      -3.9463      0.00000
     16       0.2560      0.00000
     17       3.0150      0.00000
     18       1.7095      0.00000
     19       2.1424      0.00000
     20       4.6039      0.00000

 k-point 844 :       0.0000    0.1667   -0.2917
  band No.  band energies     occupation 
      1      -0.0307      0.00000
      2       3.5183      0.00000
      3       3.2520      0.00000
      4      -9.6896      0.00000
      5      -5.7968      0.00000
      6      13.0562      0.00000
      7     -10.5496      0.00000
      8      -1.0440      0.00000
      9       7.9716      0.00000
     10      -2.9741      0.00000
     11       0.2216      0.00000
     12       7.3788      0.00000
     13       0.0469      0.00000
     14       5.7569      0.00000
     15      -4.9088      0.00000
     16       2.2279      0.00000
     17       9.9182      0.00000
     18      -9.0830      0.00000
     19      -4.4012      0.00000
     20     -11.3987      0.00000

 k-point 845 :       0.1667   -0.0000   -0.2917
  band No.  band energies     occupation 
      1      -0.0401      0.00000
      2       2.5947      0.00000
      3      -3.5250      0.00000
      4       1.1581      0.00000
      5       0.4139      0.00000
      6      -4.3978      0.00000
      7       1.6648      0.00000
      8      -3.1366      0.00000
      9       4.4799      0.00000
     10       4.0261      0.00000
     11      -3.4471      0.00000
     12       0.1741      0.00000
     13       0.1995      0.00000
     14       3.9045      0.00000
     15       3.9463      0.00000
     16      -0.2560      0.00000
     17      -3.0150      0.00000
     18      -1.7095      0.00000
     19      -2.1424      0.00000
     20      -4.6039      0.00000

 k-point 846 :       0.2917   -0.4583    0.2917
  band No.  band energies     occupation 
      1       0.0605      0.00000
      2      -2.2342      0.00000
      3       2.4402      0.00000
      4      -0.3044      0.00000
      5      -0.1309      0.00000
      6       1.5502      0.00000
      7      -1.6949      0.00000
      8       3.0333      0.00000
      9      -2.2093      0.00000
     10      -1.5122      0.00000
     11       0.9733      0.00000
     12       0.6490      0.00000
     13      -0.7543      0.00000
     14      -1.8476      0.00000
     15      -5.0811      0.00000
     16       4.5553      0.00000
     17       2.7247      0.00000
     18       0.0995      0.00000
     19       0.4567      0.00000
     20       0.1875      0.00000

 k-point 847 :       0.0000   -0.7500   -0.2917
  band No.  band energies     occupation 
      1      -0.2271      0.00000
      2       4.6783      0.00000
      3       1.2949      0.00000
      4      -8.2237      0.00000
      5      -5.7333      0.00000
      6      12.9603      0.00000
      7     -12.5271      0.00000
      8       0.7720      0.00000
      9       9.4326      0.00000
     10      -4.8640      0.00000
     11      -0.5229      0.00000
     12       4.6382      0.00000
     13       6.5547      0.00000
     14      -4.3817      0.00000
     15       2.4875      0.00000
     16       3.4969      0.00000
     17      10.0376      0.00000
     18      -3.4713      0.00000
     19     -13.2927      0.00000
     20     -10.0290      0.00000

 k-point 848 :      -0.7500   -0.0000   -0.2917
  band No.  band energies     occupation 
      1      -0.0605      0.00000
      2       2.2342      0.00000
      3      -2.4402      0.00000
      4       0.3044      0.00000
      5       0.1309      0.00000
      6      -1.5502      0.00000
      7       1.6949      0.00000
      8      -3.0333      0.00000
      9       2.2093      0.00000
     10       1.5122      0.00000
     11      -0.9733      0.00000
     12      -0.6490      0.00000
     13       0.7543      0.00000
     14       1.8476      0.00000
     15       5.0811      0.00000
     16      -4.5553      0.00000
     17      -2.7247      0.00000
     18      -0.0995      0.00000
     19      -0.4567      0.00000
     20      -0.1875      0.00000

 k-point 849 :       0.2917   -0.3750    0.2917
  band No.  band energies     occupation 
      1      -0.2448      0.00000
      2       2.4605      0.00000
      3      -2.4425      0.00000
      4       0.2248      0.00000
      5       0.1427      0.00000
      6      -1.4648      0.00000
      7       6.1254      0.00000
      8     -10.5018      0.00000
      9       5.0683      0.00000
     10       1.5442      0.00000
     11      -0.6908      0.00000
     12      -0.5919      0.00000
     13       0.3840      0.00000
     14       2.0607      0.00000
     15       6.1531      0.00000
     16      -6.2814      0.00000
     17      -2.9481      0.00000
     18       1.1402      0.00000
     19      -1.9512      0.00000
     20       2.4496      0.00000

 k-point 850 :       0.0000   -0.6667   -0.2917
  band No.  band energies     occupation 
      1      -0.8916      0.00000
      2       4.4517      0.00000
      3       1.6855      0.00000
      4      -7.0686      0.00000
      5      -5.5557      0.00000
      6      12.5115      0.00000
      7     -10.0344      0.00000
      8       1.7900      0.00000
      9       4.6802      0.00000
     10      -6.3217      0.00000
     11       1.3165      0.00000
     12       2.5640      0.00000
     13       6.8629      0.00000
     14      -2.0794      0.00000
     15       4.7220      0.00000
     16       3.5400      0.00000
     17       1.3378      0.00000
     18      -0.8379      0.00000
     19       1.8960      0.00000
     20      -5.9897      0.00000

 k-point 851 :      -0.6667   -0.0000   -0.2917
  band No.  band energies     occupation 
      1       0.2448      0.00000
      2      -2.4605      0.00000
      3       2.4425      0.00000
      4      -0.2248      0.00000
      5      -0.1427      0.00000
      6       1.4647      0.00000
      7      -6.1254      0.00000
      8      10.5018      0.00000
      9      -5.0683      0.00000
     10      -1.5442      0.00000
     11       0.6908      0.00000
     12       0.5919      0.00000
     13      -0.3840      0.00000
     14      -2.0607      0.00000
     15      -6.1531      0.00000
     16       6.2814      0.00000
     17       2.9481      0.00000
     18      -1.1402      0.00000
     19       1.9512      0.00000
     20      -2.4496      0.00000

 k-point 852 :       0.2917   -0.2917    0.2917
  band No.  band energies     occupation 
      1      -1.7314      0.00000
      2       4.8541      0.00000
      3      -3.7201      0.00000
      4       0.4784      0.00000
      5       0.5021      0.00000
      6      -1.5898      0.00000
      7      -3.6000      0.00000
      8       0.3188      0.00000
      9       2.7969      0.00000
     10      -1.1954      0.00000
     11       4.3419      0.00000
     12      -1.0464      0.00000
     13       4.7984      0.00000
     14      -1.4429      0.00000
     15       4.8675      0.00000
     16      -2.8395      0.00000
     17      -6.9677      0.00000
     18      -5.0175      0.00000
     19       5.8604      0.00000
     20       2.1640      0.00000

 k-point 853 :       0.0000   -0.5833   -0.2917
  band No.  band energies     occupation 
      1      -1.8819      0.00000
      2       3.7988      0.00000
      3       3.1915      0.00000
      4      -6.2827      0.00000
      5      -5.3683      0.00000
      6       3.6242      0.00000
      7      11.3213      0.00000
      8      -3.2551      0.00000
      9      -6.9853      0.00000
     10       4.6742      0.00000
     11      -7.0072      0.00000
     12       2.7526      0.00000
     13       0.2107      0.00000
     14       4.8759      0.00000
     15       6.1976      0.00000
     16       2.6487      0.00000
     17      -3.4153      0.00000
     18       4.2304      0.00000
     19      -1.6718      0.00000
     20      -7.0193      0.00000

 k-point 854 :      -0.5833   -0.0000   -0.2917
  band No.  band energies     occupation 
      1       1.7314      0.00000
      2      -4.8541      0.00000
      3       3.7201      0.00000
      4      -0.4784      0.00000
      5      -0.5021      0.00000
      6       1.5898      0.00000
      7       3.6000      0.00000
      8      -0.3188      0.00000
      9      -2.7969      0.00000
     10       1.1954      0.00000
     11      -4.3419      0.00000
     12       1.0464      0.00000
     13      -4.7984      0.00000
     14       1.4429      0.00000
     15      -4.8675      0.00000
     16       2.8395      0.00000
     17       6.9677      0.00000
     18       5.0175      0.00000
     19      -5.8604      0.00000
     20      -2.1640      0.00000

 k-point 855 :       0.2917    0.3750    0.3750
  band No.  band energies     occupation 
      1       0.0277      0.00000
      2      -2.4335      0.00000
      3       8.4543      0.00000
      4      -6.2397      0.00000
      5       8.8862      0.00000
      6     -10.0639      0.00000
      7       5.0304      0.00000
      8       0.6767      0.00000
      9      -1.4118      0.00000
     10      -4.0770      0.00000
     11       1.2231      0.00000
     12      -0.8637      0.00000
     13       2.5153      0.00000
     14      -7.3968      0.00000
     15      -6.6747      0.00000
     16      -6.0327      0.00000
     17       8.7789      0.00000
     18       2.6807      0.00000
     19      14.6842      0.00000
     20      -1.5109      0.00000

 k-point 856 :       0.0833    0.0833   -0.2917
  band No.  band energies     occupation 
      1      -0.0182      0.00000
      2       2.8137      0.00000
      3       2.0681      0.00000
      4      -5.8889      0.00000
      5       2.9449      0.00000
      6      -7.6909      0.00000
      7       1.0110      0.00000
      8      -4.3387      0.00000
      9       7.3608      0.00000
     10       0.6361      0.00000
     11       9.6334      0.00000
     12      -5.5225      0.00000
     13       2.7543      0.00000
     14      -1.1251      0.00000
     15      -3.2770      0.00000
     16       8.5006      0.00000
     17       2.3430      0.00000
     18      -5.5017      0.00000
     19      -5.7669      0.00000
     20      -6.1739      0.00000

 k-point 857 :       0.0000   -0.0833   -0.3750
  band No.  band energies     occupation 
      1      -0.0277      0.00000
      2       2.4335      0.00000
      3      -8.4543      0.00000
      4       6.2397      0.00000
      5      -8.8862      0.00000
      6      10.0639      0.00000
      7      -5.0304      0.00000
      8      -0.6767      0.00000
      9       1.4118      0.00000
     10       4.0770      0.00000
     11      -1.2231      0.00000
     12       0.8637      0.00000
     13      -2.5153      0.00000
     14       7.3968      0.00000
     15       6.6747      0.00000
     16       6.0327      0.00000
     17      -8.7789      0.00000
     18      -2.6807      0.00000
     19     -14.6842      0.00000
     20       1.5109      0.00000

 k-point 858 :       0.2917    0.4583    0.3750
  band No.  band energies     occupation 
      1       0.0964      0.00000
      2      -2.3574      0.00000
      3       2.6423      0.00000
      4      -0.4097      0.00000
      5       9.4380      0.00000
      6      -7.1560      0.00000
      7       1.0399      0.00000
      8      -0.6456      0.00000
      9       1.1037      0.00000
     10      -5.1850      0.00000
     11       1.6549      0.00000
     12       0.3971      0.00000
     13       0.3178      0.00000
     14      -6.4979      0.00000
     15      -6.1517      0.00000
     16      -3.5299      0.00000
     17       8.1193      0.00000
     18       3.5187      0.00000
     19      12.8332      0.00000
     20      -3.6409      0.00000

 k-point 859 :       0.3750    0.2917    0.4583
  band No.  band energies     occupation 
      1       0.1008      0.00000
      2      -2.7690      0.00000
      3       5.6356      0.00000
      4      -2.9974      0.00000
      5      -4.9616      0.00000
      6      10.6353      0.00000
      7      -2.2449      0.00000
      8       5.1462      0.00000
      9      -7.2040      0.00000
     10      -3.6883      0.00000
     11       1.7753      0.00000
     12      -1.5101      0.00000
     13      -2.9721      0.00000
     14      -0.7546      0.00000
     15      -1.7245      0.00000
     16      -0.1371      0.00000
     17      -0.8915      0.00000
     18       5.7711      0.00000
     19       2.6973      0.00000
     20       4.9318      0.00000

 k-point 860 :       0.0833    0.1667   -0.2917
  band No.  band energies     occupation 
      1      -0.0991      0.00000
      2       3.0359      0.00000
      3       4.3840      0.00000
      4      -9.2774      0.00000
      5       2.2879      0.00000
      6      -1.9088      0.00000
      7      -3.5378      0.00000
      8      -3.0932      0.00000
      9       7.3268      0.00000
     10      -2.7555      0.00000
     11       1.3501      0.00000
     12       7.6143      0.00000
     13      -0.1666      0.00000
     14      -1.8718      0.00000
     15       7.0700      0.00000
     16      -2.8349      0.00000
     17       6.4746      0.00000
     18      -3.6049      0.00000
     19     -11.9849      0.00000
     20      -6.1752      0.00000

 k-point 861 :       0.0833   -0.0833   -0.3750
  band No.  band energies     occupation 
      1      -0.0964      0.00000
      2       2.3574      0.00000
      3      -2.6423      0.00000
      4       0.4097      0.00000
      5      -9.4380      0.00000
      6       7.1560      0.00000
      7      -1.0399      0.00000
      8       0.6456      0.00000
      9      -1.1037      0.00000
     10       5.1850      0.00000
     11      -1.6549      0.00000
     12      -0.3971      0.00000
     13      -0.3178      0.00000
     14       6.4979      0.00000
     15       6.1517      0.00000
     16       3.5299      0.00000
     17      -8.1193      0.00000
     18      -3.5187      0.00000
     19     -12.8332      0.00000
     20       3.6409      0.00000

 k-point 862 :      -0.1667   -0.0833   -0.4583
  band No.  band energies     occupation 
      1      -0.1008      0.00000
      2       2.7690      0.00000
      3      -5.6356      0.00000
      4       2.9974      0.00000
      5       4.9616      0.00000
      6     -10.6353      0.00000
      7       2.2449      0.00000
      8      -5.1462      0.00000
      9       7.2040      0.00000
     10       3.6883      0.00000
     11      -1.7753      0.00000
     12       1.5101      0.00000
     13       2.9721      0.00000
     14       0.7546      0.00000
     15       1.7245      0.00000
     16       0.1371      0.00000
     17       0.8915      0.00000
     18      -5.7711      0.00000
     19      -2.6973      0.00000
     20      -4.9318      0.00000

 k-point 863 :       0.2917   -0.4583    0.3750
  band No.  band energies     occupation 
      1       0.2044      0.00000
      2      -2.4314      0.00000
      3       2.1352      0.00000
      4       0.1987      0.00000
      5       4.8112      0.00000
      6      -3.3338      0.00000
      7       2.0489      0.00000
      8      -1.6139      0.00000
      9      -0.2641      0.00000
     10      -3.1057      0.00000
     11       1.0655      0.00000
     12       3.0506      0.00000
     13      -3.1957      0.00000
     14      -6.2299      0.00000
     15      -3.6746      0.00000
     16       2.1509      0.00000
     17       6.2513      0.00000
     18       6.3662      0.00000
     19       1.0927      0.00000
     20      -2.5101      0.00000

 k-point 864 :       0.3750    0.2917   -0.4583
  band No.  band energies     occupation 
      1       0.2191      0.00000
      2      -2.9519      0.00000
      3       4.4777      0.00000
      4      -1.8812      0.00000
      5      -7.3094      0.00000
      6      12.2677      0.00000
      7      -6.9603      0.00000
      8       8.9858      0.00000
      9      -4.4397      0.00000
     10      -4.1300      0.00000
     11       1.0229      0.00000
     12      -0.8223      0.00000
     13      -1.0655      0.00000
     14      -1.8915      0.00000
     15      -3.1442      0.00000
     16       3.3137      0.00000
     17       1.9005      0.00000
     18      -2.7704      0.00000
     19       4.2519      0.00000
     20       4.7697      0.00000

 k-point 865 :       0.0833   -0.7500   -0.2917
  band No.  band energies     occupation 
      1      -0.3230      0.00000
      2       3.5082      0.00000
      3       2.9072      0.00000
      4      -8.0365      0.00000
      5      -7.2022      0.00000
      6       8.1154      0.00000
      7      -0.7527      0.00000
      8      -5.9501      0.00000
      9       9.1807      0.00000
     10      -5.0683      0.00000
     11       0.9492      0.00000
     12       5.4749      0.00000
     13       0.2532      0.00000
     14       6.4707      0.00000
     15       0.2878      0.00000
     16      -0.6932      0.00000
     17      12.0419      0.00000
     18     -12.2475      0.00000
     19      -1.9728      0.00000
     20      -7.8733      0.00000

 k-point 866 :      -0.8333   -0.0833   -0.3750
  band No.  band energies     occupation 
      1      -0.2044      0.00000
      2       2.4314      0.00000
      3      -2.1352      0.00000
      4      -0.1987      0.00000
      5      -4.8112      0.00000
      6       3.3338      0.00000
      7      -2.0489      0.00000
      8       1.6139      0.00000
      9       0.2641      0.00000
     10       3.1057      0.00000
     11      -1.0655      0.00000
     12      -3.0506      0.00000
     13       3.1957      0.00000
     14       6.2299      0.00000
     15       3.6746      0.00000
     16      -2.1509      0.00000
     17      -6.2513      0.00000
     18      -6.3662      0.00000
     19      -1.0927      0.00000
     20       2.5101      0.00000

 k-point 867 :       0.7500    0.8333    0.4583
  band No.  band energies     occupation 
      1      -0.2191      0.00000
      2       2.9519      0.00000
      3      -4.4777      0.00000
      4       1.8812      0.00000
      5       7.3094      0.00000
      6     -12.2677      0.00000
      7       6.9603      0.00000
      8      -8.9858      0.00000
      9       4.4397      0.00000
     10       4.1300      0.00000
     11      -1.0229      0.00000
     12       0.8223      0.00000
     13       1.0655      0.00000
     14       1.8915      0.00000
     15       3.1442      0.00000
     16      -3.3137      0.00000
     17      -1.9005      0.00000
     18       2.7704      0.00000
     19      -4.2519      0.00000
     20      -4.7697      0.00000

 k-point 868 :       0.2917   -0.3750    0.3750
  band No.  band energies     occupation 
      1       0.2451      0.00000
      2      -2.1506      0.00000
      3       1.8404      0.00000
      4       0.1422      0.00000
      5       0.3168      0.00000
      6       0.2464      0.00000
      7       0.3981      0.00000
      8       0.9129      0.00000
      9      -1.7939      0.00000
     10      -0.2234      0.00000
     11      -0.2009      0.00000
     12       1.7192      0.00000
     13      -1.4903      0.00000
     14      -4.0081      0.00000
     15      -1.8507      0.00000
     16       3.4753      0.00000
     17       5.1606      0.00000
     18      -1.8587      0.00000
     19      -1.5640      0.00000
     20      -0.5095      0.00000

 k-point 869 :       0.3750    0.2917   -0.3750
  band No.  band energies     occupation 
      1       0.2548      0.00000
      2      -2.6829      0.00000
      3       2.9533      0.00000
      4      -0.5577      0.00000
      5      -0.8564      0.00000
      6       3.4476      0.00000
      7      -6.4105      0.00000
      8       5.4545      0.00000
      9      -0.2571      0.00000
     10      -1.6498      0.00000
     11      -0.1458      0.00000
     12      -0.4424      0.00000
     13       1.1808      0.00000
     14      -1.1625      0.00000
     15      -4.4945      0.00000
     16       3.8451      0.00000
     17       1.3457      0.00000
     18       0.6231      0.00000
     19       1.0015      0.00000
     20      -2.8102      0.00000

 k-point 870 :       0.0833   -0.6667   -0.2917
  band No.  band energies     occupation 
      1      -0.9198      0.00000
      2       4.6199      0.00000
      3       1.6541      0.00000
      4      -6.8821      0.00000
      5      -6.3100      0.00000
      6       9.1166      0.00000
      7       1.8631      0.00000
      8      -7.0708      0.00000
      9       5.6685      0.00000
     10      -6.8716      0.00000
     11       2.8321      0.00000
     12       0.8849      0.00000
     13       5.0929      0.00000
     14       0.0136      0.00000
     15       6.7942      0.00000
     16       0.4756      0.00000
     17       1.3023      0.00000
     18       3.4931      0.00000
     19      -0.2870      0.00000
     20      -6.9155      0.00000

 k-point 871 :      -0.7500   -0.0833   -0.3750
  band No.  band energies     occupation 
      1      -0.2451      0.00000
      2       2.1506      0.00000
      3      -1.8404      0.00000
      4      -0.1422      0.00000
      5      -0.3168      0.00000
      6      -0.2464      0.00000
      7      -0.3981      0.00000
      8      -0.9129      0.00000
      9       1.7939      0.00000
     10       0.2234      0.00000
     11       0.2009      0.00000
     12      -1.7192      0.00000
     13       1.4903      0.00000
     14       4.0081      0.00000
     15       1.8507      0.00000
     16      -3.4753      0.00000
     17      -5.1606      0.00000
     18       1.8587      0.00000
     19       1.5640      0.00000
     20       0.5095      0.00000

 k-point 872 :       0.6667    0.7500    0.3750
  band No.  band energies     occupation 
      1      -0.2548      0.00000
      2       2.6829      0.00000
      3      -2.9533      0.00000
      4       0.5577      0.00000
      5       0.8564      0.00000
      6      -3.4476      0.00000
      7       6.4105      0.00000
      8      -5.4545      0.00000
      9       0.2571      0.00000
     10       1.6498      0.00000
     11       0.1458      0.00000
     12       0.4424      0.00000
     13      -1.1808      0.00000
     14       1.1625      0.00000
     15       4.4945      0.00000
     16      -3.8451      0.00000
     17      -1.3457      0.00000
     18      -0.6231      0.00000
     19      -1.0015      0.00000
     20       2.8102      0.00000

 k-point 873 :       0.2917   -0.2917    0.3750
  band No.  band energies     occupation 
      1      -1.0233      0.00000
      2       3.0658      0.00000
      3      -1.9307      0.00000
      4      -0.2215      0.00000
      5       0.0432      0.00000
      6      -1.3640      0.00000
      7       1.2031      0.00000
      8      -1.8002      0.00000
      9       2.2020      0.00000
     10      -1.0015      0.00000
     11       1.3385      0.00000
     12      -1.0992      0.00000
     13      -0.4661      0.00000
     14       3.7912      0.00000
     15       4.4175      0.00000
     16      -4.1660      0.00000
     17      -4.8572      0.00000
     18       4.2981      0.00000
     19      -3.7232      0.00000
     20       4.3240      0.00000

 k-point 874 :       0.3750    0.2917   -0.2917
  band No.  band energies     occupation 
      1      -0.9758      0.00000
      2       3.2839      0.00000
      3      -2.8065      0.00000
      4       0.5086      0.00000
      5       0.4496      0.00000
      6      -2.6847      0.00000
      7      -0.0187      0.00000
      8       2.3678      0.00000
      9      -1.5257      0.00000
     10       1.0446      0.00000
     11       1.0471      0.00000
     12       0.2979      0.00000
     13      -1.2090      0.00000
     14       0.4833      0.00000
     15       5.0123      0.00000
     16      -3.7434      0.00000
     17      -1.3506      0.00000
     18      -1.9272      0.00000
     19       0.6553      0.00000
     20       3.5404      0.00000

 k-point 875 :       0.0833   -0.5833   -0.2917
  band No.  band energies     occupation 
      1      -2.5173      0.00000
      2       4.5568      0.00000
      3       3.0000      0.00000
      4      -6.0677      0.00000
      5      -5.6779      0.00000
      6       7.5529      0.00000
      7       3.6178      0.00000
      8       0.1604      0.00000
      9      -5.2563      0.00000
     10      -2.4691      0.00000
     11       0.7432      0.00000
     12      -0.0209      0.00000
     13       2.7422      0.00000
     14       2.6989      0.00000
     15       2.6452      0.00000
     16       6.5002      0.00000
     17     -10.9069      0.00000
     18       5.7045      0.00000
     19      12.8178      0.00000
     20     -12.6636      0.00000

 k-point 876 :      -0.6667   -0.0833   -0.3750
  band No.  band energies     occupation 
      1       1.0233      0.00000
      2      -3.0658      0.00000
      3       1.9307      0.00000
      4       0.2215      0.00000
      5      -0.0432      0.00000
      6       1.3640      0.00000
      7      -1.2031      0.00000
      8       1.8002      0.00000
      9      -2.2020      0.00000
     10       1.0015      0.00000
     11      -1.3385      0.00000
     12       1.0992      0.00000
     13       0.4661      0.00000
     14      -3.7912      0.00000
     15      -4.4175      0.00000
     16       4.1660      0.00000
     17       4.8572      0.00000
     18      -4.2981      0.00000
     19       3.7232      0.00000
     20      -4.3240      0.00000

 k-point 877 :       0.5833    0.6667    0.2917
  band No.  band energies     occupation 
      1       0.9758      0.00000
      2      -3.2839      0.00000
      3       2.8065      0.00000
      4      -0.5087      0.00000
      5      -0.4496      0.00000
      6       2.6847      0.00000
      7       0.0187      0.00000
      8      -2.3678      0.00000
      9       1.5257      0.00000
     10      -1.0446      0.00000
     11      -1.0471      0.00000
     12      -0.2979      0.00000
     13       1.2090      0.00000
     14      -0.4833      0.00000
     15      -5.0123      0.00000
     16       3.7434      0.00000
     17       1.3506      0.00000
     18       1.9272      0.00000
     19      -0.6553      0.00000
     20      -3.5404      0.00000

 k-point 878 :       0.2917    0.4583    0.4583
  band No.  band energies     occupation 
      1       0.2155      0.00000
      2      -2.3188      0.00000
      3      -4.7128      0.00000
      4       7.1898      0.00000
      5       6.9544      0.00000
      6      -9.7570      0.00000
      7       4.6406      0.00000
      8      -1.9046      0.00000
      9       3.3441      0.00000
     10      -2.1974      0.00000
     11       3.9621      0.00000
     12      -4.6684      0.00000
     13       0.4561      0.00000
     14      -6.6649      0.00000
     15      -7.4692      0.00000
     16      -7.9336      0.00000
     17      13.3335      0.00000
     18      12.6466      0.00000
     19       3.2878      0.00000
     20      -3.2090      0.00000

 k-point 879 :       0.1667    0.1667   -0.2917
  band No.  band energies     occupation 
      1      -0.2443      0.00000
      2       3.0162      0.00000
      3      -4.8280      0.00000
      4       1.4646      0.00000
      5       1.7117      0.00000
      6      -7.0883      0.00000
      7       0.4151      0.00000
      8      -2.5097      0.00000
      9       6.3102      0.00000
     10      -1.6008      0.00000
     11      10.8185      0.00000
     12      -3.4234      0.00000
     13       2.0621      0.00000
     14      -0.0456      0.00000
     15       3.2305      0.00000
     16      -4.0408      0.00000
     17       5.6435      0.00000
     18      -8.6876      0.00000
     19      -0.4890      0.00000
     20      -8.1257      0.00000

 k-point 880 :       0.0000   -0.1667   -0.4583
  band No.  band energies     occupation 
      1      -0.2155      0.00000
      2       2.3188      0.00000
      3       4.7128      0.00000
      4      -7.1898      0.00000
      5      -6.9544      0.00000
      6       9.7570      0.00000
      7      -4.6406      0.00000
      8       1.9046      0.00000
      9      -3.3441      0.00000
     10       2.1974      0.00000
     11      -3.9621      0.00000
     12       4.6684      0.00000
     13      -0.4561      0.00000
     14       6.6649      0.00000
     15       7.4692      0.00000
     16       7.9336      0.00000
     17     -13.3335      0.00000
     18     -12.6466      0.00000
     19      -3.2878      0.00000
     20       3.2090      0.00000

 k-point 881 :       0.2917   -0.4583    0.4583
  band No.  band energies     occupation 
      1       0.4538      0.00000
      2      -2.5036      0.00000
      3      -2.4143      0.00000
      4       5.0393      0.00000
      5       7.0755      0.00000
      6      -7.1862      0.00000
      7       4.3422      0.00000
      8      -5.8757      0.00000
      9       3.6006      0.00000
     10      -1.6704      0.00000
     11       0.1841      0.00000
     12       1.5801      0.00000
     13      -2.4171      0.00000
     14      -5.7593      0.00000
     15      -6.1112      0.00000
     16      -3.6895      0.00000
     17       3.5450      0.00000
     18       5.7268      0.00000
     19      11.8896      0.00000
     20      -8.3869      0.00000

 k-point 882 :       0.4583    0.2917   -0.4583
  band No.  band energies     occupation 
      1       0.5094      0.00000
      2      -3.3703      0.00000
      3       7.5678      0.00000
      4      -4.7549      0.00000
      5      -3.3140      0.00000
      6      10.0982      0.00000
      7      -8.5595      0.00000
      8       8.2908      0.00000
      9      -2.9577      0.00000
     10      -0.9964      0.00000
     11      -7.1644      0.00000
     12       1.4746      0.00000
     13      -2.3540      0.00000
     14       1.0900      0.00000
     15      -1.3430      0.00000
     16       1.9346      0.00000
     17      -1.5954      0.00000
     18       2.5615      0.00000
     19      -0.7686      0.00000
     20       9.8014      0.00000

 k-point 883 :       0.1667   -0.7500   -0.2917
  band No.  band energies     occupation 
      1      -0.5743      0.00000
      2       3.4924      0.00000
      3       0.8990      0.00000
      4      -4.8214      0.00000
      5       0.5506      0.00000
      6      -3.4262      0.00000
      7       6.8365      0.00000
      8     -10.6615      0.00000
      9       7.9422      0.00000
     10      -4.7257      0.00000
     11       6.5223      0.00000
     12      -0.4311      0.00000
     13       3.8492      0.00000
     14       4.8743      0.00000
     15      -0.6276      0.00000
     16      -3.9695      0.00000
     17       9.7603      0.00000
     18       4.1444      0.00000
     19     -13.3667      0.00000
     20     -13.9374      0.00000

 k-point 884 :      -0.9167   -0.1667   -0.4583
  band No.  band energies     occupation 
      1      -0.4538      0.00000
      2       2.5036      0.00000
      3       2.4143      0.00000
      4      -5.0393      0.00000
      5      -7.0755      0.00000
      6       7.1862      0.00000
      7      -4.3422      0.00000
      8       5.8757      0.00000
      9      -3.6006      0.00000
     10       1.6704      0.00000
     11      -0.1841      0.00000
     12      -1.5801      0.00000
     13       2.4171      0.00000
     14       5.7593      0.00000
     15       6.1112      0.00000
     16       3.6895      0.00000
     17      -3.5450      0.00000
     18      -5.7268      0.00000
     19     -11.8896      0.00000
     20       8.3869      0.00000

 k-point 885 :       0.7500    0.9167    0.4583
  band No.  band energies     occupation 
      1      -0.5094      0.00000
      2       3.3703      0.00000
      3      -7.5678      0.00000
      4       4.7549      0.00000
      5       3.3140      0.00000
      6     -10.0982      0.00000
      7       8.5595      0.00000
      8      -8.2908      0.00000
      9       2.9577      0.00000
     10       0.9964      0.00000
     11       7.1644      0.00000
     12      -1.4746      0.00000
     13       2.3540      0.00000
     14      -1.0900      0.00000
     15       1.3430      0.00000
     16      -1.9346      0.00000
     17       1.5954      0.00000
     18      -2.5615      0.00000
     19       0.7686      0.00000
     20      -9.8014      0.00000

 k-point 886 :       0.2917   -0.3750    0.4583
  band No.  band energies     occupation 
      1       0.8804      0.00000
      2      -2.9927      0.00000
      3      -0.5741      0.00000
      4       3.1334      0.00000
      5       8.6445      0.00000
      6      -8.5392      0.00000
      7       1.7065      0.00000
      8      -3.0688      0.00000
      9       1.2718      0.00000
     10       1.1017      0.00000
     11      -2.6676      0.00000
     12       4.2028      0.00000
     13      -3.7139      0.00000
     14      -7.4003      0.00000
     15       0.1542      0.00000
     16       0.7187      0.00000
     17       2.3192      0.00000
     18      -4.3678      0.00000
     19       2.9959      0.00000
     20       3.4638      0.00000

 k-point 887 :       0.4583    0.2917   -0.3750
  band No.  band energies     occupation 
      1       0.9146      0.00000
      2      -4.0910      0.00000
      3       6.4816      0.00000
      4      -3.3843      0.00000
      5     -10.1893      0.00000
      6      16.9204      0.00000
      7      -5.3420      0.00000
      8      -0.2801      0.00000
      9       2.7881      0.00000
     10      -2.3086      0.00000
     11      -4.4408      0.00000
     12       0.0699      0.00000
     13       1.3715      0.00000
     14       1.5049      0.00000
     15      -3.7411      0.00000
     16       0.0157      0.00000
     17       3.5644      0.00000
     18      -4.9115      0.00000
     19       1.0577      0.00000
     20       3.7160      0.00000

 k-point 888 :       0.1667   -0.6667   -0.2917
  band No.  band energies     occupation 
      1      -1.2877      0.00000
      2       4.3355      0.00000
      3       1.9682      0.00000
      4      -5.9308      0.00000
      5      -4.9977      0.00000
      6       3.0011      0.00000
      7       4.0499      0.00000
      8      -6.4264      0.00000
      9       6.9336      0.00000
     10      -5.9081      0.00000
     11       5.7663      0.00000
     12      -2.8248      0.00000
     13       1.7285      0.00000
     14       7.1323      0.00000
     15       1.4548      0.00000
     16       0.5630      0.00000
     17       4.5769      0.00000
     18     -12.6780      0.00000
     19      11.2707      0.00000
     20      -6.7074      0.00000

 k-point 889 :      -0.8333   -0.1667   -0.4583
  band No.  band energies     occupation 
      1      -0.8804      0.00000
      2       2.9927      0.00000
      3       0.5741      0.00000
      4      -3.1334      0.00000
      5      -8.6445      0.00000
      6       8.5392      0.00000
      7      -1.7065      0.00000
      8       3.0688      0.00000
      9      -1.2718      0.00000
     10      -1.1017      0.00000
     11       2.6676      0.00000
     12      -4.2028      0.00000
     13       3.7139      0.00000
     14       7.4003      0.00000
     15      -0.1542      0.00000
     16      -0.7187      0.00000
     17      -2.3192      0.00000
     18       4.3678      0.00000
     19      -2.9959      0.00000
     20      -3.4638      0.00000

 k-point 890 :       0.6667    0.8333    0.3750
  band No.  band energies     occupation 
      1      -0.9146      0.00000
      2       4.0910      0.00000
      3      -6.4816      0.00000
      4       3.3843      0.00000
      5      10.1893      0.00000
      6     -16.9204      0.00000
      7       5.3420      0.00000
      8       0.2801      0.00000
      9      -2.7881      0.00000
     10       2.3086      0.00000
     11       4.4408      0.00000
     12      -0.0699      0.00000
     13      -1.3715      0.00000
     14      -1.5049      0.00000
     15       3.7411      0.00000
     16      -0.0157      0.00000
     17      -3.5644      0.00000
     18       4.9115      0.00000
     19      -1.0577      0.00000
     20      -3.7160      0.00000

 k-point 891 :       0.2917   -0.2917    0.4583
  band No.  band energies     occupation 
      1       1.1953      0.00000
      2      -2.7907      0.00000
      3       0.6727      0.00000
      4       1.0870      0.00000
      5       0.7149      0.00000
      6       0.8534      0.00000
      7      -4.0003      0.00000
      8       2.8014      0.00000
      9      -1.2841      0.00000
     10       1.6810      0.00000
     11      -1.9988      0.00000
     12       1.8035      0.00000
     13       1.3768      0.00000
     14      -5.6899      0.00000
     15      -3.1548      0.00000
     16       4.0415      0.00000
     17       0.4935      0.00000
     18      -1.4639      0.00000
     19       7.8179      0.00000
     20      -7.4877      0.00000

 k-point 892 :       0.4583    0.2917   -0.2917
  band No.  band energies     occupation 
      1       0.9923      0.00000
      2      -3.0665      0.00000
      3       3.1900      0.00000
      4      -1.1318      0.00000
      5      -1.9701      0.00000
      6       7.0392      0.00000
      7      -6.7084      0.00000
      8       1.4133      0.00000
      9       1.9354      0.00000
     10      -1.2456      0.00000
     11      -1.4937      0.00000
     12       0.1266      0.00000
     13       1.9833      0.00000
     14      -0.4572      0.00000
     15      -3.8109      0.00000
     16       1.7207      0.00000
     17       4.2733      0.00000
     18      -4.2823      0.00000
     19      -0.5457      0.00000
     20       0.8114      0.00000

 k-point 893 :       0.1667   -0.5833   -0.2917
  band No.  band energies     occupation 
      1      -2.6288      0.00000
      2       4.8336      0.00000
      3       3.0125      0.00000
      4      -5.8063      0.00000
      5      -7.5161      0.00000
      6      10.3237      0.00000
      7      -2.2774      0.00000
      8       0.8840      0.00000
      9       0.2041      0.00000
     10      -3.6693      0.00000
     11       3.7612      0.00000
     12      -3.0477      0.00000
     13      -0.8265      0.00000
     14       4.8048      0.00000
     15       3.0682      0.00000
     16       6.1987      0.00000
     17      -4.6446      0.00000
     18       0.5451      0.00000
     19       9.7605      0.00000
     20     -16.8247      0.00000

 k-point 894 :      -0.7500   -0.1667   -0.4583
  band No.  band energies     occupation 
      1      -1.1953      0.00000
      2       2.7907      0.00000
      3      -0.6727      0.00000
      4      -1.0870      0.00000
      5      -0.7149      0.00000
      6      -0.8534      0.00000
      7       4.0003      0.00000
      8      -2.8014      0.00000
      9       1.2841      0.00000
     10      -1.6810      0.00000
     11       1.9988      0.00000
     12      -1.8035      0.00000
     13      -1.3768      0.00000
     14       5.6899      0.00000
     15       3.1548      0.00000
     16      -4.0415      0.00000
     17      -0.4935      0.00000
     18       1.4639      0.00000
     19      -7.8179      0.00000
     20       7.4877      0.00000

 k-point 895 :       0.5833    0.7500    0.2917
  band No.  band energies     occupation 
      1      -0.9923      0.00000
      2       3.0665      0.00000
      3      -3.1900      0.00000
      4       1.1318      0.00000
      5       1.9701      0.00000
      6      -7.0392      0.00000
      7       6.7084      0.00000
      8      -1.4133      0.00000
      9      -1.9354      0.00000
     10       1.2456      0.00000
     11       1.4937      0.00000
     12      -0.1266      0.00000
     13      -1.9833      0.00000
     14       0.4572      0.00000
     15       3.8109      0.00000
     16      -1.7207      0.00000
     17      -4.2733      0.00000
     18       4.2823      0.00000
     19       0.5457      0.00000
     20      -0.8114      0.00000

 k-point 896 :       0.2917   -0.4583   -0.4583
  band No.  band energies     occupation 
      1       0.9639      0.00000
      2      -2.9195      0.00000
      3      -3.5245      0.00000
      4       6.4721      0.00000
      5       5.7365      0.00000
      6     -10.6050      0.00000
      7      -4.0451      0.00000
      8       4.8116      0.00000
      9       5.8255      0.00000
     10      -3.8877      0.00000
     11       6.1953      0.00000
     12      -3.8556      0.00000
     13      -0.1841      0.00000
     14      -4.5765      0.00000
     15      -7.8559      0.00000
     16     -10.0951      0.00000
     17      -1.3212      0.00000
     18      10.6466      0.00000
     19      18.1985      0.00000
     20      -9.4588      0.00000

 k-point 897 :      -0.7500   -0.7500   -0.2917
  band No.  band energies     occupation 
      1      -1.0766      0.00000
      2       4.0677      0.00000
      3      -4.0237      0.00000
      4       0.8025      0.00000
      5       0.8639      0.00000
      6      -5.2559      0.00000
      7      -3.3189      0.00000
      8       1.8158      0.00000
      9       3.9914      0.00000
     10      -1.7060      0.00000
     11       6.7845      0.00000
     12      -1.7159      0.00000
     13       4.8729      0.00000
     14      -0.2337      0.00000
     15       1.5121      0.00000
     16      -4.9818      0.00000
     17       2.1851      0.00000
     18      -8.6923      0.00000
     19       9.6337      0.00000
     20      -6.4705      0.00000

 k-point 898 :       0.0000    0.7500    0.4583
  band No.  band energies     occupation 
      1      -0.9639      0.00000
      2       2.9195      0.00000
      3       3.5245      0.00000
      4      -6.4721      0.00000
      5      -5.7365      0.00000
      6      10.6050      0.00000
      7       4.0451      0.00000
      8      -4.8116      0.00000
      9      -5.8255      0.00000
     10       3.8877      0.00000
     11      -6.1953      0.00000
     12       3.8556      0.00000
     13       0.1841      0.00000
     14       4.5765      0.00000
     15       7.8559      0.00000
     16      10.0951      0.00000
     17       1.3212      0.00000
     18     -10.6466      0.00000
     19     -18.1985      0.00000
     20       9.4588      0.00000

 k-point 899 :       0.2917   -0.3750   -0.4583
  band No.  band energies     occupation 
      1       1.8755      0.00000
      2      -3.8464      0.00000
      3      -3.2197      0.00000
      4       6.1430      0.00000
      5       5.9086      0.00000
      6      -9.3644      0.00000
      7       0.4555      0.00000
      8      -2.2831      0.00000
      9       5.5223      0.00000
     10       0.9688      0.00000
     11       0.4355      0.00000
     12      -0.2206      0.00000
     13      -2.4281      0.00000
     14      -3.6199      0.00000
     15      -5.2855      0.00000
     16      -3.9110      0.00000
     17       9.7699      0.00000
     18      -9.8966      0.00000
     19      -1.5346      0.00000
     20      10.4802      0.00000

 k-point 900 :      -0.4583    0.2917   -0.3750
  band No.  band energies     occupation 
      1       1.6795      0.00000
      2      -4.9329      0.00000
      3       4.8774      0.00000
      4      -1.6531      0.00000
      5      -1.3653      0.00000
      6       8.9385      0.00000
      7      -3.4304      0.00000
      8      -3.0143      0.00000
      9       2.2781      0.00000
     10      -1.8807      0.00000
     11      -3.6510      0.00000
     12      -0.2018      0.00000
     13      -1.4742      0.00000
     14       2.9694      0.00000
     15      -4.2480      0.00000
     16      -1.4875      0.00000
     17       7.1799      0.00000
     18       2.8255      0.00000
     19      -2.4252      0.00000
     20      -4.6869      0.00000

 k-point 901 :      -0.7500   -0.6667   -0.2917
  band No.  band energies     occupation 
      1      -1.8087      0.00000
      2       4.8212      0.00000
      3      -2.5212      0.00000
      4      -0.8419      0.00000
      5       0.1455      0.00000
      6      -4.2307      0.00000
      7       3.6501      0.00000
      8      -4.8016      0.00000
      9       6.0197      0.00000
     10      -3.0658      0.00000
     11       4.2926      0.00000
     12      -2.8398      0.00000
     13       5.2286      0.00000
     14       2.1835      0.00000
     15       2.9134      0.00000
     16      -1.9717      0.00000
     17      -3.8951      0.00000
     18      -9.6557      0.00000
     19       7.3345      0.00000
     20       3.5861      0.00000

 k-point 902 :       0.0833    0.7500    0.4583
  band No.  band energies     occupation 
      1      -1.8755      0.00000
      2       3.8464      0.00000
      3       3.2197      0.00000
      4      -6.1430      0.00000
      5      -5.9086      0.00000
      6       9.3644      0.00000
      7      -0.4555      0.00000
      8       2.2831      0.00000
      9      -5.5223      0.00000
     10      -0.9688      0.00000
     11      -0.4355      0.00000
     12       0.2206      0.00000
     13       2.4281      0.00000
     14       3.6199      0.00000
     15       5.2855      0.00000
     16       3.9110      0.00000
     17      -9.7699      0.00000
     18       9.8966      0.00000
     19       1.5346      0.00000
     20     -10.4802      0.00000

 k-point 903 :       0.6667   -0.0833    0.3750
  band No.  band energies     occupation 
      1      -1.6795      0.00000
      2       4.9329      0.00000
      3      -4.8774      0.00000
      4       1.6531      0.00000
      5       1.3653      0.00000
      6      -8.9385      0.00000
      7       3.4304      0.00000
      8       3.0143      0.00000
      9      -2.2781      0.00000
     10       1.8807      0.00000
     11       3.6510      0.00000
     12       0.2018      0.00000
     13       1.4742      0.00000
     14      -2.9694      0.00000
     15       4.2480      0.00000
     16       1.4875      0.00000
     17      -7.1799      0.00000
     18      -2.8255      0.00000
     19       2.4252      0.00000
     20       4.6869      0.00000

 k-point 904 :       0.2917   -0.3750   -0.3750
  band No.  band energies     occupation 
      1       2.4740      0.00000
      2      -4.4360      0.00000
      3      -2.9646      0.00000
      4       6.1931      0.00000
      5       5.1843      0.00000
      6      -3.5140      0.00000
      7     -11.9101      0.00000
      8       1.3470      0.00000
      9       8.8223      0.00000
     10      -5.1711      0.00000
     11       7.5971      0.00000
     12      -1.7689      0.00000
     13      -0.4545      0.00000
     14      -5.3615      0.00000
     15      -2.3898      0.00000
     16      -6.4974      0.00000
     17       7.6466      0.00000
     18      -9.3804      0.00000
     19      -3.2582      0.00000
     20      -9.3071      0.00000

 k-point 905 :      -0.6667   -0.6667   -0.2917
  band No.  band energies     occupation 
      1      -0.9770      0.00000
      2       3.2265      0.00000
      3      -2.4451      0.00000
      4       0.1587      0.00000
      5       0.1677      0.00000
      6      -0.5102      0.00000
      7      -1.3068      0.00000
      8      -0.1751      0.00000
      9       1.1976      0.00000
     10      -0.4233      0.00000
     11       1.5255      0.00000
     12      -0.3456      0.00000
     13       2.2691      0.00000
     14      -0.8056      0.00000
     15       5.1094      0.00000
     16      -4.8121      0.00000
     17      -2.9990      0.00000
     18      -2.9009      0.00000
     19       1.8550      0.00000
     20       3.2633      0.00000

 k-point 906 :       0.0000    0.6667    0.3750
  band No.  band energies     occupation 
      1      -2.4740      0.00000
      2       4.4360      0.00000
      3       2.9646      0.00000
      4      -6.1931      0.00000
      5      -5.1843      0.00000
      6       3.5140      0.00000
      7      11.9101      0.00000
      8      -1.3470      0.00000
      9      -8.8223      0.00000
     10       5.1711      0.00000
     11      -7.5971      0.00000
     12       1.7689      0.00000
     13       0.4545      0.00000
     14       5.3615      0.00000
     15       2.3898      0.00000
     16       6.4974      0.00000
     17      -7.6466      0.00000
     18       9.3804      0.00000
     19       3.2582      0.00000
     20       9.3071      0.00000

 k-point 907 :       0.0000    0.0000   -0.3750
  band No.  band energies     occupation 
      1      -0.0752      0.00000
      2       2.5333      0.00000
      3      -9.8042      0.00000
      4       6.8579      0.00000
      5     -15.3184      0.00000
      6      11.7764      0.00000
      7      -0.7713      0.00000
      8      -5.2013      0.00000
      9       7.4778      0.00000
     10      -1.6568      0.00000
     11      12.3355      0.00000
     12      -5.5189      0.00000
     13      -2.1285      0.00000
     14       5.3708      0.00000
     15       7.5664      0.00000
     16      -6.2913      0.00000
     17       7.0945      0.00000
     18      -6.4766      0.00000
     19     -13.5921      0.00000
     20      -0.2697      0.00000

 k-point 908 :       0.3750    0.4583    0.3750
  band No.  band energies     occupation 
      1       0.1996      0.00000
      2      -2.5250      0.00000
      3       4.6805      0.00000
      4      -2.4062      0.00000
      5      -2.1324      0.00000
      6       8.0186      0.00000
      7      -1.3275      0.00000
      8       5.0915      0.00000
      9      -8.4023      0.00000
     10      -7.7846      0.00000
     11       6.4502      0.00000
     12      -1.4064      0.00000
     13      -1.1496      0.00000
     14      -4.1531      0.00000
     15      -4.6613      0.00000
     16      -2.9404      0.00000
     17       3.4552      0.00000
     18       5.9188      0.00000
     19       2.2091      0.00000
     20       8.4871      0.00000

 k-point 909 :       0.0000    0.0833   -0.3750
  band No.  band energies     occupation 
      1      -0.2012      0.00000
      2       2.7177      0.00000
      3       5.6370      0.00000
      4      -9.7851      0.00000
      5     -10.1283      0.00000
      6      12.4312      0.00000
      7      -5.6125      0.00000
      8      -5.2044      0.00000
      9       8.8835      0.00000
     10      -2.5614      0.00000
     11      -0.8193      0.00000
     12       9.9511      0.00000
     13       1.4351      0.00000
     14      -2.0386      0.00000
     15       9.1760      0.00000
     16      -5.2345      0.00000
     17       8.9133      0.00000
     18      -7.1507      0.00000
     19      -8.0567      0.00000
     20      -7.9772      0.00000

 k-point 910 :       0.0833    0.0000   -0.3750
  band No.  band energies     occupation 
      1      -0.1996      0.00000
      2       2.5250      0.00000
      3      -4.6805      0.00000
      4       2.4062      0.00000
      5       2.1324      0.00000
      6      -8.0185      0.00000
      7       1.3275      0.00000
      8      -5.0915      0.00000
      9       8.4023      0.00000
     10       7.7846      0.00000
     11      -6.4502      0.00000
     12       1.4064      0.00000
     13       1.1496      0.00000
     14       4.1531      0.00000
     15       4.6613      0.00000
     16       2.9404      0.00000
     17      -3.4552      0.00000
     18      -5.9188      0.00000
     19      -2.2091      0.00000
     20      -8.4871      0.00000

 k-point 911 :       0.3750   -0.4583    0.3750
  band No.  band energies     occupation 
      1       0.4390      0.00000
      2      -2.7962      0.00000
      3       3.7558      0.00000
      4      -1.4897      0.00000
      5      -0.8330      0.00000
      6       6.3408      0.00000
      7      -1.8307      0.00000
      8       6.5371      0.00000
      9      -8.7758      0.00000
     10      -6.3842      0.00000
     11       4.4395      0.00000
     12       0.6182      0.00000
     13      -2.8245      0.00000
     14      -4.6395      0.00000
     15      -3.3291      0.00000
     16       0.6700      0.00000
     17       6.8734      0.00000
     18       1.4997      0.00000
     19       1.5655      0.00000
     20       4.7392      0.00000

 k-point 912 :       0.0000   -0.8333   -0.3750
  band No.  band energies     occupation 
      1      -0.5026      0.00000
      2       3.1009      0.00000
      3       3.9566      0.00000
      4      -8.5065      0.00000
      5      -6.9991      0.00000
      6      12.1412      0.00000
      7      -6.8579      0.00000
      8      -4.7945      0.00000
      9       9.2398      0.00000
     10      -3.9799      0.00000
     11      -2.2945      0.00000
     12       9.5933      0.00000
     13       0.7948      0.00000
     14      -2.0300      0.00000
     15       9.3621      0.00000
     16      -2.2666      0.00000
     17      12.8258      0.00000
     18      -4.8783      0.00000
     19      -9.7473      0.00000
     20      -8.1354      0.00000

 k-point 913 :      -0.8333    0.0000   -0.3750
  band No.  band energies     occupation 
      1      -0.4390      0.00000
      2       2.7962      0.00000
      3      -3.7558      0.00000
      4       1.4897      0.00000
      5       0.8330      0.00000
      6      -6.3408      0.00000
      7       1.8307      0.00000
      8      -6.5371      0.00000
      9       8.7758      0.00000
     10       6.3842      0.00000
     11      -4.4395      0.00000
     12      -0.6182      0.00000
     13       2.8245      0.00000
     14       4.6395      0.00000
     15       3.3291      0.00000
     16      -0.6700      0.00000
     17      -6.8734      0.00000
     18      -1.4997      0.00000
     19      -1.5655      0.00000
     20      -4.7392      0.00000

 k-point 914 :       0.3750   -0.3750    0.3750
  band No.  band energies     occupation 
      1       0.8299      0.00000
      2      -3.4339      0.00000
      3       3.2984      0.00000
      4      -0.6740      0.00000
      5      -0.4424      0.00000
      6       4.0355      0.00000
      7      -3.6134      0.00000
      8       9.3268      0.00000
      9      -7.7713      0.00000
     10      -4.3337      0.00000
     11       1.9522      0.00000
     12       1.1974      0.00000
     13      -4.4916      0.00000
     14      -0.8373      0.00000
     15      -4.9030      0.00000
     16       4.6410      0.00000
     17       6.7016      0.00000
     18      -2.9985      0.00000
     19       4.6419      0.00000
     20      -0.3341      0.00000

 k-point 915 :       0.0000   -0.7500   -0.3750
  band No.  band energies     occupation 
      1      -1.1700      0.00000
      2       3.8150      0.00000
      3       2.8247      0.00000
      4      -7.1688      0.00000
      5      -5.8385      0.00000
      6      11.9905      0.00000
      7      -6.6615      0.00000
      8       0.2694      0.00000
      9       2.8291      0.00000
     10      -5.7982      0.00000
     11       0.7392      0.00000
     12       4.5938      0.00000
     13      -1.5293      0.00000
     14       3.7486      0.00000
     15       8.0277      0.00000
     16       1.5027      0.00000
     17       4.7386      0.00000
     18      -1.4999      0.00000
     19      -3.4613      0.00000
     20      -7.5630      0.00000

 k-point 916 :      -0.7500    0.0000   -0.3750
  band No.  band energies     occupation 
      1      -0.8298      0.00000
      2       3.4339      0.00000
      3      -3.2984      0.00000
      4       0.6740      0.00000
      5       0.4424      0.00000
      6      -4.0355      0.00000
      7       3.6134      0.00000
      8      -9.3268      0.00000
      9       7.7713      0.00000
     10       4.3337      0.00000
     11      -1.9522      0.00000
     12      -1.1974      0.00000
     13       4.4916      0.00000
     14       0.8373      0.00000
     15       4.9030      0.00000
     16      -4.6410      0.00000
     17      -6.7016      0.00000
     18       2.9985      0.00000
     19      -4.6419      0.00000
     20       0.3341      0.00000

 k-point 917 :       0.3750    0.4583    0.4583
  band No.  band energies     occupation 
      1       0.4145      0.00000
      2      -2.6056      0.00000
      3      -6.2278      0.00000
      4       8.6356      0.00000
      5      10.5871      0.00000
      6     -10.9684      0.00000
      7       4.3372      0.00000
      8       3.1107      0.00000
      9      -6.1090      0.00000
     10       1.6369      0.00000
     11      -7.2567      0.00000
     12       3.2290      0.00000
     13       0.3710      0.00000
     14      -6.0089      0.00000
     15      -6.5804      0.00000
     16      -8.2752      0.00000
     17      11.9170      0.00000
     18       5.6224      0.00000
     19      17.4094      0.00000
     20      -2.9792      0.00000

 k-point 918 :       0.0833    0.0833   -0.3750
  band No.  band energies     occupation 
      1      -0.4300      0.00000
      2       2.7898      0.00000
      3      -5.2520      0.00000
      4       2.3524      0.00000
      5       2.7975      0.00000
      6      -8.5282      0.00000
      7       1.1515      0.00000
      8      -5.8904      0.00000
      9       9.9727      0.00000
     10      -1.7712      0.00000
     11      -4.0096      0.00000
     12      11.1056      0.00000
     13       1.8532      0.00000
     14       0.3677      0.00000
     15       5.9134      0.00000
     16      -3.4424      0.00000
     17       5.8696      0.00000
     18      -4.4500      0.00000
     19      -6.6772      0.00000
     20      -5.2208      0.00000

 k-point 919 :       0.0000   -0.0833   -0.4583
  band No.  band energies     occupation 
      1      -0.4145      0.00000
      2       2.6056      0.00000
      3       6.2278      0.00000
      4      -8.6356      0.00000
      5     -10.5871      0.00000
      6      10.9684      0.00000
      7      -4.3372      0.00000
      8      -3.1107      0.00000
      9       6.1090      0.00000
     10      -1.6369      0.00000
     11       7.2567      0.00000
     12      -3.2290      0.00000
     13      -0.3710      0.00000
     14       6.0089      0.00000
     15       6.5804      0.00000
     16       8.2751      0.00000
     17     -11.9170      0.00000
     18      -5.6224      0.00000
     19     -17.4094      0.00000
     20       2.9792      0.00000

 k-point 920 :       0.3750   -0.4583    0.4583
  band No.  band energies     occupation 
      1       0.8622      0.00000
      2      -3.0658      0.00000
      3      -0.1050      0.00000
      4       2.7577      0.00000
      5      10.3163      0.00000
      6      -8.6206      0.00000
      7       1.6126      0.00000
      8       2.7722      0.00000
      9      -5.4061      0.00000
     10       1.1813      0.00000
     11      -3.3827      0.00000
     12       1.4531      0.00000
     13      -2.3865      0.00000
     14      -4.8515      0.00000
     15      -6.1046      0.00000
     16      -4.7478      0.00000
     17       6.1091      0.00000
     18      10.3172      0.00000
     19      11.6630      0.00000
     20      -4.5306      0.00000

 k-point 921 :       0.4583    0.3750   -0.4583
  band No.  band energies     occupation 
      1       0.8957      0.00000
      2      -3.2809      0.00000
      3       7.6425      0.00000
      4      -5.3855      0.00000
      5     -10.4910      0.00000
      6      17.3929      0.00000
      7      -2.3137      0.00000
      8       7.4777      0.00000
      9     -10.0795      0.00000
     10      -0.5464      0.00000
     11      -4.2718      0.00000
     12       0.0352      0.00000
     13      -1.7239      0.00000
     14      -3.3222      0.00000
     15      -0.9155      0.00000
     16      -1.0407      0.00000
     17       1.1912      0.00000
     18      -1.6484      0.00000
     19       3.7716      0.00000
     20      11.0097      0.00000

 k-point 922 :       0.0833   -0.8333   -0.3750
  band No.  band energies     occupation 
      1      -0.9226      0.00000
      2       3.3247      0.00000
      3       3.8035      0.00000
      4      -7.3442      0.00000
      5      -4.8298      0.00000
      6       4.0740      0.00000
      7      -2.2043      0.00000
      8      -5.4750      0.00000
      9       9.3558      0.00000
     10      -4.9193      0.00000
     11      -0.1093      0.00000
     12       8.3131      0.00000
     13       2.7868      0.00000
     14      -0.1321      0.00000
     15       7.0457      0.00000
     16      -5.2518      0.00000
     17      12.4578      0.00000
     18       1.5928      0.00000
     19     -10.3656      0.00000
     20     -15.7238      0.00000

 k-point 923 :      -0.9167   -0.0833   -0.4583
  band No.  band energies     occupation 
      1      -0.8622      0.00000
      2       3.0658      0.00000
      3       0.1050      0.00000
      4      -2.7577      0.00000
      5     -10.3163      0.00000
      6       8.6206      0.00000
      7      -1.6126      0.00000
      8      -2.7722      0.00000
      9       5.4061      0.00000
     10      -1.1813      0.00000
     11       3.3827      0.00000
     12      -1.4531      0.00000
     13       2.3865      0.00000
     14       4.8515      0.00000
     15       6.1046      0.00000
     16       4.7478      0.00000
     17      -6.1091      0.00000
     18     -10.3172      0.00000
     19     -11.6630      0.00000
     20       4.5306      0.00000

 k-point 924 :       0.8333    0.9167    0.4583
  band No.  band energies     occupation 
      1      -0.8957      0.00000
      2       3.2809      0.00000
      3      -7.6425      0.00000
      4       5.3855      0.00000
      5      10.4910      0.00000
      6     -17.3929      0.00000
      7       2.3137      0.00000
      8      -7.4777      0.00000
      9      10.0795      0.00000
     10       0.5464      0.00000
     11       4.2718      0.00000
     12      -0.0352      0.00000
     13       1.7239      0.00000
     14       3.3222      0.00000
     15       0.9155      0.00000
     16       1.0407      0.00000
     17      -1.1912      0.00000
     18       1.6484      0.00000
     19      -3.7716      0.00000
     20     -11.0097      0.00000

 k-point 925 :       0.3750   -0.3750    0.4583
  band No.  band energies     occupation 
      1       1.5705      0.00000
      2      -3.9828      0.00000
      3       1.2827      0.00000
      4       1.6100      0.00000
      5       1.8584      0.00000
      6      -0.0564      0.00000
      7       0.3170      0.00000
      8       5.6664      0.00000
      9      -7.9673      0.00000
     10       2.3895      0.00000
     11      -4.4523      0.00000
     12       3.5064      0.00000
     13      -6.8014      0.00000
     14      -2.1769      0.00000
     15      -3.9003      0.00000
     16       0.7984      0.00000
     17       2.2902      0.00000
     18      15.6732      0.00000
     19     -13.6217      0.00000
     20       7.8832      0.00000

 k-point 926 :       0.4583    0.3750   -0.3750
  band No.  band energies     occupation 
      1       1.5900      0.00000
      2      -4.2316      0.00000
      3       5.8938      0.00000
      4      -3.3911      0.00000
      5      -4.8331      0.00000
      6      11.2916      0.00000
      7      -5.8326      0.00000
      8       9.3243      0.00000
      9      -6.2318      0.00000
     10      -2.1889      0.00000
     11      -4.4896      0.00000
     12       0.3674      0.00000
     13      -0.5867      0.00000
     14      -5.0602      0.00000
     15       1.4673      0.00000
     16      -1.9821      0.00000
     17       8.4692      0.00000
     18      -3.0411      0.00000
     19       2.4178      0.00000
     20       6.4554      0.00000

 k-point 927 :       0.0833   -0.7500   -0.3750
  band No.  band energies     occupation 
      1      -1.6868      0.00000
      2       4.0888      0.00000
      3       3.3706      0.00000
      4      -6.9728      0.00000
      5      -7.5857      0.00000
      6       7.9867      0.00000
      7      -1.1416      0.00000
      8      -2.2468      0.00000
      9       4.3746      0.00000
     10      -4.8253      0.00000
     11       1.3565      0.00000
     12       3.0222      0.00000
     13       2.4565      0.00000
     14       1.1388      0.00000
     15       8.2180      0.00000
     16       0.8418      0.00000
     17       8.3650      0.00000
     18      -2.2291      0.00000
     19     -15.8532      0.00000
     20      -0.9506      0.00000

 k-point 928 :      -0.8333   -0.0833   -0.4583
  band No.  band energies     occupation 
      1      -1.5705      0.00000
      2       3.9828      0.00000
      3      -1.2827      0.00000
      4      -1.6100      0.00000
      5      -1.8584      0.00000
      6       0.0564      0.00000
      7      -0.3170      0.00000
      8      -5.6664      0.00000
      9       7.9673      0.00000
     10      -2.3895      0.00000
     11       4.4523      0.00000
     12      -3.5064      0.00000
     13       6.8014      0.00000
     14       2.1769      0.00000
     15       3.9003      0.00000
     16      -0.7984      0.00000
     17      -2.2902      0.00000
     18     -15.6732      0.00000
     19      13.6217      0.00000
     20      -7.8832      0.00000

 k-point 929 :       0.7500    0.8333    0.3750
  band No.  band energies     occupation 
      1      -1.5900      0.00000
      2       4.2316      0.00000
      3      -5.8938      0.00000
      4       3.3911      0.00000
      5       4.8331      0.00000
      6     -11.2916      0.00000
      7       5.8326      0.00000
      8      -9.3243      0.00000
      9       6.2318      0.00000
     10       2.1889      0.00000
     11       4.4896      0.00000
     12      -0.3674      0.00000
     13       0.5867      0.00000
     14       5.0602      0.00000
     15      -1.4673      0.00000
     16       1.9821      0.00000
     17      -8.4692      0.00000
     18       3.0411      0.00000
     19      -2.4178      0.00000
     20      -6.4554      0.00000

 k-point 930 :       0.3750   -0.4583   -0.4583
  band No.  band energies     occupation 
      1       1.5437      0.00000
      2      -3.7533      0.00000
      3      -4.4021      0.00000
      4       7.6927      0.00000
      5       7.3385      0.00000
      6     -10.9705      0.00000
      7       5.1525      0.00000
      8       1.2139      0.00000
      9      -3.0047      0.00000
     10       1.8459      0.00000
     11       4.6176      0.00000
     12      -8.1966      0.00000
     13       0.2248      0.00000
     14      -4.8120      0.00000
     15      -7.9003      0.00000
     16     -11.2747      0.00000
     17       3.1879      0.00000
     18      15.4331      0.00000
     19      16.2940      0.00000
     20      -3.9614      0.00000

 k-point 931 :      -0.8333   -0.8333   -0.3750
  band No.  band energies     occupation 
      1      -1.5899      0.00000
      2       4.0024      0.00000
      3      -4.1653      0.00000
      4       1.5685      0.00000
      5       1.2658      0.00000
      6      -7.1724      0.00000
      7       1.4565      0.00000
      8      -6.1599      0.00000
      9       9.2776      0.00000
     10      -3.7479      0.00000
     11       8.6130      0.00000
     12      -1.6515      0.00000
     13       3.9180      0.00000
     14       2.2162      0.00000
     15       1.9727      0.00000
     16      -4.3567      0.00000
     17       4.3234      0.00000
     18       5.2346      0.00000
     19      -9.5384      0.00000
     20     -12.4341      0.00000

 k-point 932 :       0.0000    0.8333    0.4583
  band No.  band energies     occupation 
      1      -1.5437      0.00000
      2       3.7533      0.00000
      3       4.4021      0.00000
      4      -7.6927      0.00000
      5      -7.3385      0.00000
      6      10.9705      0.00000
      7      -5.1525      0.00000
      8      -1.2139      0.00000
      9       3.0047      0.00000
     10      -1.8459      0.00000
     11      -4.6176      0.00000
     12       8.1966      0.00000
     13      -0.2248      0.00000
     14       4.8120      0.00000
     15       7.9003      0.00000
     16      11.2747      0.00000
     17      -3.1879      0.00000
     18     -15.4331      0.00000
     19     -16.2940      0.00000
     20       3.9614      0.00000

 k-point 933 :       0.0000    0.0000   -0.4583
  band No.  band energies     occupation 
      1      -0.8331      0.00000
      2       3.0409      0.00000
      3      -9.6076      0.00000
      4       7.0643      0.00000
      5     -16.2708      0.00000
      6      11.9607      0.00000
      7      -0.4718      0.00000
      8      -5.7753      0.00000
      9      10.2643      0.00000
     10      -7.4002      0.00000
     11      -3.1099      0.00000
     12      15.2844      0.00000
     13      -0.3460      0.00000
     14       3.0578      0.00000
     15       6.5662      0.00000
     16      -8.2474      0.00000
     17       9.7952      0.00000
     18      -4.6766      0.00000
     19      -7.8323      0.00000
     20       2.9969      0.00000

 k-point 934 :       0.4583   -0.4583    0.4583
  band No.  band energies     occupation 
      1       1.4979      0.00000
      2      -3.7143      0.00000
      3       4.8637      0.00000
      4      -2.4756      0.00000
      5      -2.5173      0.00000
      6       8.6206      0.00000
      7      -1.2676      0.00000
      8       6.2143      0.00000
      9     -10.8646      0.00000
     10       6.7647      0.00000
     11      -9.8425      0.00000
     12      -0.1524      0.00000
     13      -2.9380      0.00000
     14      -1.5151      0.00000
     15      -4.8509      0.00000
     16      -5.2504      0.00000
     17       4.8494      0.00000
     18       1.0277      0.00000
     19      -0.8315      0.00000
     20      13.6657      0.00000

 k-point 935 :      -0.0000   -0.9167   -0.4583
  band No.  band energies     occupation 
      1      -1.5057      0.00000
      2       3.7273      0.00000
      3       6.0207      0.00000
      4      -9.0822      0.00000
      5     -10.9521      0.00000
      6      11.7652      0.00000
      7      -4.4430      0.00000
      8      -5.3689      0.00000
      9       9.5341      0.00000
     10      -6.2360      0.00000
     11      -3.5779      0.00000
     12      14.0309      0.00000
     13      -0.3115      0.00000
     14       2.8693      0.00000
     15       7.3920      0.00000
     16      -7.4702      0.00000
     17      12.2250      0.00000
     18      -2.3761      0.00000
     19      -8.3734      0.00000
     20       0.1712      0.00000

 k-point 936 :      -0.9167    0.0000   -0.4583
  band No.  band energies     occupation 
      1      -1.4979      0.00000
      2       3.7143      0.00000
      3      -4.8637      0.00000
      4       2.4756      0.00000
      5       2.5173      0.00000
      6      -8.6206      0.00000
      7       1.2676      0.00000
      8      -6.2143      0.00000
      9      10.8646      0.00000
     10      -6.7647      0.00000
     11       9.8425      0.00000
     12       0.1524      0.00000
     13       2.9380      0.00000
     14       1.5151      0.00000
     15       4.8509      0.00000
     16       5.2504      0.00000
     17      -4.8494      0.00000
     18      -1.0277      0.00000
     19       0.8315      0.00000
     20     -13.6657      0.00000


------------------------ aborting loop because EDIFF is reached ----------------------------------------


 FEWALD executed in parallel
    FORLOC:  cpu time    0.0000: real time    0.0003
    FORNL :  cpu time    0.0280: real time    0.0277
    STRESS:  cpu time    0.4859: real time    0.4863
    FORCOR:  cpu time    0.0000: real time    0.0006
    OFIELD:  cpu time    0.0000: real time    0.0000
 FEWALD executed in parallel
    FORLOC:  cpu time    0.0000: real time    0.0001
    FORNL :  cpu time    0.0210: real time    0.0213
    STRESS:  cpu time    0.4869: real time    0.4864
    FORCOR:  cpu time    0.0000: real time    0.0006
    OFIELD:  cpu time    0.0000: real time    0.0000
 FEWALD executed in parallel
    FORLOC:  cpu time    0.0000: real time    0.0001
    FORNL :  cpu time    0.0210: real time    0.0213
    STRESS:  cpu time    0.4859: real time    0.4864
    FORCOR:  cpu time    0.0010: real time    0.0006
    OFIELD:  cpu time    0.0000: real time    0.0000
 FEWALD executed in parallel
    FORLOC:  cpu time    0.0000: real time    0.0001
    FORNL :  cpu time    0.0220: real time    0.0215
    STRESS:  cpu time    0.4859: real time    0.4863
    FORCOR:  cpu time    0.0010: real time    0.0006
    OFIELD:  cpu time    0.0000: real time    0.0000

 INTERNAL STRAIN TENSOR  FOR ION    1  DIRECTION 1   (eV/Angst):
 -----------------------------------------------------------------------------
    -0.00004  0.00000  0.00000
     0.00000  0.00002  4.92971
    -0.00000  4.92971  0.00002


 POSITION                   FORCE-CONSTANT FOR ION    1 DIRECTION 1 (eV/Angst/Angst)
 -----------------------------------------------------------------------------------
      0.00000      0.00000      0.00000       -39.280612      0.000000      0.000000
      0.88158      0.88158      0.88158        39.280612     -0.000000     -0.000000
 -----------------------------------------------------------------------------------
    total drift:                                0.000000      0.000000      0.000000


 BORN EFFECTIVE CHARGE FOR ION    1 DIRECTION 1 :   0.001   0.000   0.000
                   rigid augmentation           :  -0.113   0.000   0.000
                   ionic contribution           :   4.000   0.000   0.000
                   Berry contribution           :  -3.886   0.000   0.000


--------------------------------------------------------------------------------------------------------


  LATTYP: Found a face centered cubic cell.
 ALAT       =     3.5263137898
  
  Lattice vectors:
  
 A1 = (   0.0000000000,   1.7631568949,   1.7631568949)
 A2 = (   1.7631568949,   0.0000000000,   1.7631568949)
 A3 = (   1.7631568949,   1.7631568949,   0.0000000000)


Analysis of symmetry for initial positions (statically):
=====================================================================
 Subroutine PRICEL returns:
 Original cell was already a primitive cell.
 

 Routine SETGRP: Setting up the symmetry group for a 
 face centered cubic supercell.


 Subroutine GETGRP returns: Found 48 space group operations
 (whereof 24 operations were pure point group operations)
 out of a pool of 48 trial point group operations.


The static configuration has the point symmetry T_d .
 The point group associated with its full space group is O_h .


Analysis of symmetry for dynamics (positions and initial velocities):
=====================================================================
 Subroutine PRICEL returns:
 Original cell was already a primitive cell.
 

 Routine SETGRP: Setting up the symmetry group for a 
 face centered cubic supercell.


 Subroutine GETGRP returns: Found 48 space group operations
 (whereof 24 operations were pure point group operations)
 out of a pool of 48 trial point group operations.


The dynamic configuration has the point symmetry T_d .
 The point group associated with its full space group is O_h .


Analysis of constrained symmetry for selective dynamics:
=====================================================================
 Subroutine PRICEL returns:
 Original cell was already a primitive cell.
 

 Routine SETGRP: Setting up the symmetry group for a 
 face centered cubic supercell.


 Subroutine GETGRP returns: Found 48 space group operations
 (whereof 24 operations were pure point group operations)
 out of a pool of 48 trial point group operations.


The constrained configuration has the point symmetry T_d .
 The point group associated with its full space group is O_h .


--------------------------------------------------------------------------------------------------------




 MACROSCOPIC STATIC DIELECTRIC TENSOR (including local field effects in DFT)
 ------------------------------------------------------
           5.753464     0.000000    -0.000000
          -0.000000     5.753464     0.000000
           0.000000    -0.000000     5.753464
 ------------------------------------------------------


 PIEZOELECTRIC TENSOR  for field in x, y, z        (e  Angst)
          XX          YY          ZZ          XY          YZ          ZX
  --------------------------------------------------------------------------------
  x     0.00020    -0.00015    -0.00015     0.00000     0.00000     0.00000
  y    -0.00015     0.00020    -0.00015     0.00000     0.00000    -0.00000
  z    -0.00015    -0.00015     0.00020     0.00000     0.00000     0.00000

 PIEZOELECTRIC TENSOR  for field in x, y, z        (C/m^2)
          XX          YY          ZZ          XY          YZ          ZX
  --------------------------------------------------------------------------------
  x     0.00000     0.00000     0.00000     0.00000     0.00000     0.00000
  y     0.00000    -0.00000     0.00000     0.00000     0.00000     0.00000
  z     0.00000     0.00000     0.00000     0.00000     0.00000     0.00000
 
 BORN EFFECTIVE CHARGES (in e, cummulative output)
 -------------------------------------------------
 ion    1
    1     0.00125     0.00000     0.00000
    2     0.00000     0.00125     0.00000
    3    -0.00000    -0.00000     0.00125
 ion    2
    1     0.00125    -0.00000    -0.00000
    2    -0.00000     0.00125    -0.00000
    3     0.00000     0.00000     0.00125

 INTERNAL STRAIN TENSOR FOR ION    1 for displacements in x,y,z  (eV/Angst):
          X           Y           Z          XY          YZ          ZX
  --------------------------------------------------------------------------------
  x     0.00000    -0.00000    -0.00000    -0.00000     4.92971    -0.00000
  y    -0.00000     0.00000    -0.00000     0.00000    -0.00000     4.92971
  z    -0.00000    -0.00000     0.00000     4.92971    -0.00000    -0.00000

 INTERNAL STRAIN TENSOR FOR ION    2 for displacements in x,y,z  (eV/Angst):
          X           Y           Z          XY          YZ          ZX
  --------------------------------------------------------------------------------
  x    -0.00000     0.00000     0.00000     0.00000    -4.92971     0.00000
  y     0.00000    -0.00000     0.00000    -0.00000     0.00000    -4.92971
  z     0.00000     0.00000    -0.00000    -4.92971     0.00000     0.00000


--------------------------------------------------------------------------------------------------------


 
 SECOND DERIVATIVES (NOT SYMMETRIZED)
 ------------------------------------
               1X          1Y          1Z          2X          2Y          2Z 
  1X   -39.280612    0.000000    0.000000   39.280612    0.000000    0.000000
  1Y     0.000000  -39.280612    0.000000    0.000000   39.280612    0.000000
  1Z     0.000000    0.000000  -39.280612    0.000000    0.000000   39.280612
  2X    39.280612    0.000000    0.000000  -39.280612    0.000000    0.000000
  2Y     0.000000   39.280612    0.000000    0.000000  -39.280612    0.000000
  2Z     0.000000    0.000000   39.280612    0.000000    0.000000  -39.280612
 
 
 Eigenvectors and eigenvalues of the dynamical matrix
 ----------------------------------------------------
 
 
   1 f  =   39.982068 THz   251.214744 2PiTHz 1333.658203 cm-1   165.352603 meV
             X         Y         Z           dx          dy          dz
      0.000000  0.000000  0.000000     0.000000   -0.707107    0.000000  
      0.881578  0.881578  0.881578     0.000000    0.707107    0.000000  
 
   2 f  =   39.982068 THz   251.214744 2PiTHz 1333.658203 cm-1   165.352603 meV
             X         Y         Z           dx          dy          dz
      0.000000  0.000000  0.000000    -0.707107    0.000000    0.000000  
      0.881578  0.881578  0.881578     0.707107    0.000000    0.000000  
 
   3 f  =   39.982068 THz   251.214744 2PiTHz 1333.658203 cm-1   165.352603 meV
             X         Y         Z           dx          dy          dz
      0.000000  0.000000  0.000000     0.000000    0.000000   -0.707107  
      0.881578  0.881578  0.881578     0.000000    0.000000    0.707107  
 
   4 f  =    0.000000 THz     0.000000 2PiTHz    0.000000 cm-1     0.000000 meV
             X         Y         Z           dx          dy          dz
      0.000000  0.000000  0.000000     0.707107    0.000000    0.000000  
      0.881578  0.881578  0.881578     0.707107    0.000000    0.000000  
 
   5 f  =    0.000000 THz     0.000000 2PiTHz    0.000000 cm-1     0.000000 meV
             X         Y         Z           dx          dy          dz
      0.000000  0.000000  0.000000     0.000000    0.707107    0.000000  
      0.881578  0.881578  0.881578     0.000000    0.707107    0.000000  
 
   6 f  =    0.000000 THz     0.000000 2PiTHz    0.000000 cm-1     0.000000 meV
             X         Y         Z           dx          dy          dz
      0.000000  0.000000  0.000000     0.000000    0.000000    0.707107  
      0.881578  0.881578  0.881578     0.000000    0.000000    0.707107  
 


--------------------------------------------------------------------------------------------------------




 MACROSCOPIC STATIC DIELECTRIC TENSOR IONIC CONTRIBUTION
 ------------------------------------------------------
           0.000000     0.000000     0.000000
           0.000000     0.000000     0.000000
           0.000000     0.000000     0.000000
 ------------------------------------------------------


 ELASTIC MODULI IONIC CONTR (kBar)
 Direction    XX          YY          ZZ          XY          YZ          ZX
 --------------------------------------------------------------------------------
 XX          -0.0000      0.0000      0.0000      0.0000     -0.0000      0.0000
 YY           0.0000     -0.0000     -0.0000      0.0000      0.0000     -0.0000
 ZZ           0.0000     -0.0000     -0.0000     -0.0000      0.0000      0.0000
 XY           0.0000      0.0000     -0.0000    -90.4215      0.0000      0.0000
 YZ          -0.0000      0.0000      0.0000      0.0000    -90.4215      0.0000
 ZX           0.0000     -0.0000      0.0000      0.0000      0.0000    -90.4215
 --------------------------------------------------------------------------------


 PIEZOELECTRIC TENSOR IONIC CONTR  for field in x, y, z        (C/m^2)
          XX          YY          ZZ          XY          YZ          ZX
  --------------------------------------------------------------------------------
  x     0.00000    -0.00000    -0.00000     0.00000     0.00000     0.00000
  y     0.00000     0.00000    -0.00000     0.00000     0.00000     0.00000
  z    -0.00000    -0.00000     0.00000     0.00000    -0.00000    -0.00000


--------------------------------------------------------------------------------------------------------


     LOOP+:  cpu time   60.6688: real time   61.1978
    4ORBIT:  cpu time    0.0000: real time    0.0000
 


 total charge     
 
# of ion     s       p       d       tot
----------------------------------------
  1        0.829   1.793   0.000   2.622
  2        0.829   1.793   0.000   2.622
------------------------------------------------
tot        1.658   3.587   0.000   5.245
 

 total amount of memory used by VASP on root node    33632. kBytes
========================================================================

   base      :      30000. kBytes
   nonl-proj :       2569. kBytes
   fftplans  :         89. kBytes
   grid      :        270. kBytes
   one-center:          6. kBytes
   wavefun   :        698. kBytes
 
  
  
 General timing and accounting informations for this job:
 ========================================================
  
                  Total CPU time used (sec):       67.564
                            User time (sec):       67.157
                          System time (sec):        0.407
                         Elapsed time (sec):       69.489
  
                   Maximum memory used (kb):      183436.
                   Average memory used (kb):           0.
  
                          Minor page faults:        43085
                          Major page faults:            0
                 Voluntary context switches:         2973
