 vasp.5.4.4.18Apr17-6-g9f103f2a35 (build Aug 01 2018 12:10:22) complex          
  
 executed on        TETRALITH-B01 date 2021.09.25  19:03:33
 running on   32 total cores
 distrk:  each k-point on   16 cores,    2 groups
 distr:  one band on NCORES_PER_BAND=   8 cores,    2 groups


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


 INCAR:
 POTCAR:    PAW_PBE C 08Apr2002                   
 POTCAR:    PAW_PBE H 15Jun2001                   
 POTCAR:    PAW_PBE N 08Apr2002                   

 ----------------------------------------------------------------------------- 
|                                                                             |
|           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_PBE C 08Apr2002                   
   VRHFIN =C: s2p2                                                              
   LEXCH  = PE                                                                  
   EATOM  =   147.1560 eV,   10.8157 Ry                                         
                                                                                
   TITEL  = PAW_PBE C 08Apr2002                                                 
   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      -273.3789   2.0000                                         
     2  0  0.50       -13.7508   2.0000                                         
     2  1  0.50        -5.2854   2.0000                                         
     3  2  1.50        -5.4423   0.0000                                         
   Description                                                                  
     l       E           TYP  RCUT    TYP  RCUT                                 
     0    -13.7508458     23  1.200                                             
     0     -8.2022199     23  1.200                                             
     1     -5.2854383     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
  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
 
 POTCAR:    PAW_PBE H 15Jun2001                   
   VRHFIN =H: ultrasoft test                                                    
   LEXCH  = PE                                                                  
   EATOM  =    12.4884 eV,    0.9179 Ry                                         
                                                                                
   TITEL  = PAW_PBE H 15Jun2001                                                 
   LULTRA =        F    use ultrasoft PP ?                                      
   IUNSCR =        0    unscreen: 0-lin 1-nonlin 2-no                           
   RPACOR =    0.000    partial core radius                                     
   POMASS =    1.000; ZVAL   =    1.000    mass and valenz                      
   RCORE  =    1.100    outmost cutoff radius                                   
   RWIGS  =    0.700; RWIGS  =    0.370    wigner-seitz radius (au A)           
   ENMAX  =  250.000; ENMIN  =  200.000 eV                                      
   RCLOC  =    0.701    cutoff for local pot                                    
   LCOR   =        T    correct aug charges                                     
   LPAW   =        T    paw PP                                                  
   EAUG   =  400.000                                                            
   RMAX   =    1.123    core radius for proj-oper                               
   RAUG   =    1.200    factor for augmentation sphere                          
   RDEP   =    1.112    radius for radial grids                                 
   RDEPT  =    0.926    core radius for aug-charge                              
                                                                                
   Atomic configuration                                                         
    2 entries                                                                   
     n  l   j            E        occ.                                          
     1  0  0.50        -6.4927   1.0000                                         
     2  1  0.50        -3.4015   0.0000                                         
   Description                                                                  
     l       E           TYP  RCUT    TYP  RCUT                                 
     0     -6.4927494     23  1.100                                             
     0      6.8029130     23  1.100                                             
     1     -4.0817478     23  1.100                                             
  local pseudopotential 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
    PAW grid and wavefunctions read in
 
   number of l-projection  operators is LMAX  =           3
   number of lm-projection operators is LMMAX =           5
 
 POTCAR:    PAW_PBE N 08Apr2002                   
   VRHFIN =N: s2p3                                                              
   LEXCH  = PE                                                                  
   EATOM  =   264.5486 eV,   19.4438 Ry                                         
                                                                                
   TITEL  = PAW_PBE N 08Apr2002                                                 
   LULTRA =        F    use ultrasoft PP ?                                      
   IUNSCR =        1    unscreen: 0-lin 1-nonlin 2-no                           
   RPACOR =    1.200    partial core radius                                     
   POMASS =   14.001; ZVAL   =    5.000    mass and valenz                      
   RCORE  =    1.500    outmost cutoff radius                                   
   RWIGS  =    1.400; RWIGS  =    0.741    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   =  627.112                                                            
   DEXC   =    0.000                                                            
   RMAX   =    1.529    core radius for proj-oper                               
   RAUG   =    1.300    factor for augmentation sphere                          
   RDEP   =    1.514    radius for radial grids                                 
   RDEPT  =    1.338    core radius for aug-charge                              
                                                                                
   Atomic configuration                                                         
    4 entries                                                                   
     n  l   j            E        occ.                                          
     1  0  0.50      -384.7179   2.0000                                         
     2  0  0.50       -18.5828   2.0000                                         
     2  1  0.50        -7.0898   3.0000                                         
     3  2  1.50        -6.8029   0.0000                                         
   Description                                                                  
     l       E           TYP  RCUT    TYP  RCUT                                 
     0    -18.5828119     23  1.200                                             
     0    -13.5018863     23  1.200                                             
     1     -7.0897853     23  1.500                                             
     1      9.5240782     23  1.500                                             
     2     -6.8029130      7  1.500                                             
  local pseudopotential read in
  partial core-charges read in
  partial kinetic energy density 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_PBE C 08Apr2002                   :
 energy of atom  1       EATOM= -147.1560
 kinetic energy error for atom=    0.0016 (will be added to EATOM!!)
  PAW_PBE H 15Jun2001                   :
 energy of atom  2       EATOM=  -12.4884
 kinetic energy error for atom=    0.0002 (will be added to EATOM!!)
  PAW_PBE N 08Apr2002                   :
 energy of atom  3       EATOM= -264.5486
 kinetic energy error for atom=    0.0029 (will be added to EATOM!!)
 
 
 POSCAR: findsym-output                          
  positions in cartesian coordinates
  No initial velocities read in
 exchange correlation table for  LEXCH =        8
   RHO(1)=    0.500       N(1)  =     2000
   RHO(2)=  100.500       N(2)  =     4000
 


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


 ion  position               nearest neighbor table
   1  0.576  0.900  0.984-   5 1.12  12 1.45   9 1.47  10 1.48
   2  0.076  0.076  0.024-   6 1.12  11 1.45  10 1.47   9 1.48
   3  0.576  0.400  0.024-   7 1.12  10 1.45  11 1.47  12 1.48
   4  0.076  0.576  0.984-   8 1.12   9 1.45  12 1.47  11 1.48
   5  0.653  0.999  0.951-   1 1.12
   6  0.153  0.977  0.057-   2 1.12
   7  0.653  0.499  0.057-   3 1.12
   8  0.152  0.477  0.951-   4 1.12
   9  0.209  0.890  0.987-   4 1.45   1 1.47   2 1.48
  10  0.709  0.086  0.022-   3 1.45   2 1.47   1 1.48
  11  0.209  0.390  0.022-   2 1.45   3 1.47   4 1.48
  12  0.709  0.586  0.987-   1 1.45   4 1.47   3 1.48
 
  LATTYP: Found a simple orthorhombic cell.
 ALAT       =     4.0010948181
 B/A-ratio  =     1.0768179439
 C/A-ratio  =     7.4979477778
  
  Lattice vectors:
  
 A1 = (   4.0010948181,   0.0000000000,   0.0000000000)
 A2 = (   0.0000000000,   4.3084506953,   0.0000000000)
 A3 = (   0.0000000000,   0.0000000000,  30.0000000000)


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 
 simple orthorhombic supercell.


 Subroutine GETGRP returns: Found  1 space group operations
 (whereof  1 operations were pure point group operations)
 out of a pool of  8 trial point group operations.


The static configuration has the point symmetry C_1 .


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 
 simple orthorhombic supercell.


 Subroutine GETGRP returns: Found  1 space group operations
 (whereof  1 operations were pure point group operations)
 out of a pool of  8 trial point group operations.


The dynamic configuration has the point symmetry C_1 .


 Subroutine INISYM returns: Found  1 space group operations
 (whereof  1 operations are pure point group operations),
 and found     1 'primitive' translations

 
 

Automatic generation of k-mesh.
 generate k-points for:   16   15    3
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
 
 Subroutine IBZKPT returns following result:
 ===========================================
 
 Found    361 irreducible k-points:
 
 Following reciprocal coordinates:
            Coordinates               Weight
  0.000000  0.000000  0.000000      1.000000
  0.062500  0.000000  0.000000      2.000000
  0.125000  0.000000  0.000000      2.000000
  0.187500  0.000000  0.000000      2.000000
  0.250000  0.000000  0.000000      2.000000
  0.312500  0.000000  0.000000      2.000000
  0.375000  0.000000  0.000000      2.000000
  0.437500  0.000000  0.000000      2.000000
  0.500000  0.000000  0.000000      1.000000
  0.000000  0.066667  0.000000      2.000000
  0.062500  0.066667  0.000000      2.000000
  0.125000  0.066667  0.000000      2.000000
  0.187500  0.066667  0.000000      2.000000
  0.250000  0.066667  0.000000      2.000000
  0.312500  0.066667  0.000000      2.000000
  0.375000  0.066667  0.000000      2.000000
  0.437500  0.066667  0.000000      2.000000
  0.500000  0.066667  0.000000      2.000000
 -0.437500  0.066667  0.000000      2.000000
 -0.375000  0.066667  0.000000      2.000000
 -0.312500  0.066667  0.000000      2.000000
 -0.250000  0.066667  0.000000      2.000000
 -0.187500  0.066667  0.000000      2.000000
 -0.125000  0.066667  0.000000      2.000000
 -0.062500  0.066667  0.000000      2.000000
  0.000000  0.133333  0.000000      2.000000
  0.062500  0.133333  0.000000      2.000000
  0.125000  0.133333  0.000000      2.000000
  0.187500  0.133333  0.000000      2.000000
  0.250000  0.133333  0.000000      2.000000
  0.312500  0.133333  0.000000      2.000000
  0.375000  0.133333  0.000000      2.000000
  0.437500  0.133333  0.000000      2.000000
  0.500000  0.133333  0.000000      2.000000
 -0.437500  0.133333  0.000000      2.000000
 -0.375000  0.133333  0.000000      2.000000
 -0.312500  0.133333  0.000000      2.000000
 -0.250000  0.133333  0.000000      2.000000
 -0.187500  0.133333  0.000000      2.000000
 -0.125000  0.133333  0.000000      2.000000
 -0.062500  0.133333  0.000000      2.000000
  0.000000  0.200000  0.000000      2.000000
  0.062500  0.200000  0.000000      2.000000
  0.125000  0.200000  0.000000      2.000000
  0.187500  0.200000  0.000000      2.000000
  0.250000  0.200000  0.000000      2.000000
  0.312500  0.200000  0.000000      2.000000
  0.375000  0.200000  0.000000      2.000000
  0.437500  0.200000  0.000000      2.000000
  0.500000  0.200000  0.000000      2.000000
 -0.437500  0.200000  0.000000      2.000000
 -0.375000  0.200000  0.000000      2.000000
 -0.312500  0.200000  0.000000      2.000000
 -0.250000  0.200000  0.000000      2.000000
 -0.187500  0.200000  0.000000      2.000000
 -0.125000  0.200000  0.000000      2.000000
 -0.062500  0.200000  0.000000      2.000000
  0.000000  0.266667  0.000000      2.000000
  0.062500  0.266667  0.000000      2.000000
  0.125000  0.266667  0.000000      2.000000
  0.187500  0.266667  0.000000      2.000000
  0.250000  0.266667  0.000000      2.000000
  0.312500  0.266667  0.000000      2.000000
  0.375000  0.266667  0.000000      2.000000
  0.437500  0.266667  0.000000      2.000000
  0.500000  0.266667  0.000000      2.000000
 -0.437500  0.266667  0.000000      2.000000
 -0.375000  0.266667  0.000000      2.000000
 -0.312500  0.266667  0.000000      2.000000
 -0.250000  0.266667  0.000000      2.000000
 -0.187500  0.266667  0.000000      2.000000
 -0.125000  0.266667  0.000000      2.000000
 -0.062500  0.266667  0.000000      2.000000
  0.000000  0.333333  0.000000      2.000000
  0.062500  0.333333  0.000000      2.000000
  0.125000  0.333333  0.000000      2.000000
  0.187500  0.333333  0.000000      2.000000
  0.250000  0.333333  0.000000      2.000000
  0.312500  0.333333  0.000000      2.000000
  0.375000  0.333333  0.000000      2.000000
  0.437500  0.333333  0.000000      2.000000
  0.500000  0.333333  0.000000      2.000000
 -0.437500  0.333333  0.000000      2.000000
 -0.375000  0.333333  0.000000      2.000000
 -0.312500  0.333333  0.000000      2.000000
 -0.250000  0.333333  0.000000      2.000000
 -0.187500  0.333333  0.000000      2.000000
 -0.125000  0.333333  0.000000      2.000000
 -0.062500  0.333333  0.000000      2.000000
  0.000000  0.400000  0.000000      2.000000
  0.062500  0.400000  0.000000      2.000000
  0.125000  0.400000  0.000000      2.000000
  0.187500  0.400000  0.000000      2.000000
  0.250000  0.400000  0.000000      2.000000
  0.312500  0.400000  0.000000      2.000000
  0.375000  0.400000  0.000000      2.000000
  0.437500  0.400000  0.000000      2.000000
  0.500000  0.400000  0.000000      2.000000
 -0.437500  0.400000  0.000000      2.000000
 -0.375000  0.400000  0.000000      2.000000
 -0.312500  0.400000  0.000000      2.000000
 -0.250000  0.400000  0.000000      2.000000
 -0.187500  0.400000  0.000000      2.000000
 -0.125000  0.400000  0.000000      2.000000
 -0.062500  0.400000  0.000000      2.000000
  0.000000  0.466667  0.000000      2.000000
  0.062500  0.466667  0.000000      2.000000
  0.125000  0.466667  0.000000      2.000000
  0.187500  0.466667  0.000000      2.000000
  0.250000  0.466667  0.000000      2.000000
  0.312500  0.466667  0.000000      2.000000
  0.375000  0.466667  0.000000      2.000000
  0.437500  0.466667  0.000000      2.000000
  0.500000  0.466667  0.000000      2.000000
 -0.437500  0.466667  0.000000      2.000000
 -0.375000  0.466667  0.000000      2.000000
 -0.312500  0.466667  0.000000      2.000000
 -0.250000  0.466667  0.000000      2.000000
 -0.187500  0.466667  0.000000      2.000000
 -0.125000  0.466667  0.000000      2.000000
 -0.062500  0.466667  0.000000      2.000000
  0.000000  0.000000  0.333333      2.000000
  0.062500  0.000000  0.333333      2.000000
  0.125000  0.000000  0.333333      2.000000
  0.187500  0.000000  0.333333      2.000000
  0.250000  0.000000  0.333333      2.000000
  0.312500  0.000000  0.333333      2.000000
  0.375000  0.000000  0.333333      2.000000
  0.437500  0.000000  0.333333      2.000000
  0.500000  0.000000  0.333333      2.000000
 -0.437500  0.000000  0.333333      2.000000
 -0.375000  0.000000  0.333333      2.000000
 -0.312500  0.000000  0.333333      2.000000
 -0.250000  0.000000  0.333333      2.000000
 -0.187500  0.000000  0.333333      2.000000
 -0.125000  0.000000  0.333333      2.000000
 -0.062500  0.000000  0.333333      2.000000
  0.000000  0.066667  0.333333      2.000000
  0.062500  0.066667  0.333333      2.000000
  0.125000  0.066667  0.333333      2.000000
  0.187500  0.066667  0.333333      2.000000
  0.250000  0.066667  0.333333      2.000000
  0.312500  0.066667  0.333333      2.000000
  0.375000  0.066667  0.333333      2.000000
  0.437500  0.066667  0.333333      2.000000
  0.500000  0.066667  0.333333      2.000000
 -0.437500  0.066667  0.333333      2.000000
 -0.375000  0.066667  0.333333      2.000000
 -0.312500  0.066667  0.333333      2.000000
 -0.250000  0.066667  0.333333      2.000000
 -0.187500  0.066667  0.333333      2.000000
 -0.125000  0.066667  0.333333      2.000000
 -0.062500  0.066667  0.333333      2.000000
  0.000000  0.133333  0.333333      2.000000
  0.062500  0.133333  0.333333      2.000000
  0.125000  0.133333  0.333333      2.000000
  0.187500  0.133333  0.333333      2.000000
  0.250000  0.133333  0.333333      2.000000
  0.312500  0.133333  0.333333      2.000000
  0.375000  0.133333  0.333333      2.000000
  0.437500  0.133333  0.333333      2.000000
  0.500000  0.133333  0.333333      2.000000
 -0.437500  0.133333  0.333333      2.000000
 -0.375000  0.133333  0.333333      2.000000
 -0.312500  0.133333  0.333333      2.000000
 -0.250000  0.133333  0.333333      2.000000
 -0.187500  0.133333  0.333333      2.000000
 -0.125000  0.133333  0.333333      2.000000
 -0.062500  0.133333  0.333333      2.000000
  0.000000  0.200000  0.333333      2.000000
  0.062500  0.200000  0.333333      2.000000
  0.125000  0.200000  0.333333      2.000000
  0.187500  0.200000  0.333333      2.000000
  0.250000  0.200000  0.333333      2.000000
  0.312500  0.200000  0.333333      2.000000
  0.375000  0.200000  0.333333      2.000000
  0.437500  0.200000  0.333333      2.000000
  0.500000  0.200000  0.333333      2.000000
 -0.437500  0.200000  0.333333      2.000000
 -0.375000  0.200000  0.333333      2.000000
 -0.312500  0.200000  0.333333      2.000000
 -0.250000  0.200000  0.333333      2.000000
 -0.187500  0.200000  0.333333      2.000000
 -0.125000  0.200000  0.333333      2.000000
 -0.062500  0.200000  0.333333      2.000000
  0.000000  0.266667  0.333333      2.000000
  0.062500  0.266667  0.333333      2.000000
  0.125000  0.266667  0.333333      2.000000
  0.187500  0.266667  0.333333      2.000000
  0.250000  0.266667  0.333333      2.000000
  0.312500  0.266667  0.333333      2.000000
  0.375000  0.266667  0.333333      2.000000
  0.437500  0.266667  0.333333      2.000000
  0.500000  0.266667  0.333333      2.000000
 -0.437500  0.266667  0.333333      2.000000
 -0.375000  0.266667  0.333333      2.000000
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 -0.031241  0.077367  0.011111      2.000000
 -0.015621  0.077367  0.011111      2.000000
  0.000000  0.092841  0.011111      2.000000
  0.015621  0.092841  0.011111      2.000000
  0.031241  0.092841  0.011111      2.000000
  0.046862  0.092841  0.011111      2.000000
  0.062483  0.092841  0.011111      2.000000
  0.078104  0.092841  0.011111      2.000000
  0.093724  0.092841  0.011111      2.000000
  0.109345  0.092841  0.011111      2.000000
  0.124966  0.092841  0.011111      2.000000
 -0.109345  0.092841  0.011111      2.000000
 -0.093724  0.092841  0.011111      2.000000
 -0.078104  0.092841  0.011111      2.000000
 -0.062483  0.092841  0.011111      2.000000
 -0.046862  0.092841  0.011111      2.000000
 -0.031241  0.092841  0.011111      2.000000
 -0.015621  0.092841  0.011111      2.000000
  0.000000  0.108314  0.011111      2.000000
  0.015621  0.108314  0.011111      2.000000
  0.031241  0.108314  0.011111      2.000000
  0.046862  0.108314  0.011111      2.000000
  0.062483  0.108314  0.011111      2.000000
  0.078104  0.108314  0.011111      2.000000
  0.093724  0.108314  0.011111      2.000000
  0.109345  0.108314  0.011111      2.000000
  0.124966  0.108314  0.011111      2.000000
 -0.109345  0.108314  0.011111      2.000000
 -0.093724  0.108314  0.011111      2.000000
 -0.078104  0.108314  0.011111      2.000000
 -0.062483  0.108314  0.011111      2.000000
 -0.046862  0.108314  0.011111      2.000000
 -0.031241  0.108314  0.011111      2.000000
 -0.015621  0.108314  0.011111      2.000000
  0.000000 -0.108314  0.011111      2.000000
  0.015621 -0.108314  0.011111      2.000000
  0.031241 -0.108314  0.011111      2.000000
  0.046862 -0.108314  0.011111      2.000000
  0.062483 -0.108314  0.011111      2.000000
  0.078104 -0.108314  0.011111      2.000000
  0.093724 -0.108314  0.011111      2.000000
  0.109345 -0.108314  0.011111      2.000000
  0.124966 -0.108314  0.011111      2.000000
 -0.109345 -0.108314  0.011111      2.000000
 -0.093724 -0.108314  0.011111      2.000000
 -0.078104 -0.108314  0.011111      2.000000
 -0.062483 -0.108314  0.011111      2.000000
 -0.046862 -0.108314  0.011111      2.000000
 -0.031241 -0.108314  0.011111      2.000000
 -0.015621 -0.108314  0.011111      2.000000
  0.000000 -0.092841  0.011111      2.000000
  0.015621 -0.092841  0.011111      2.000000
  0.031241 -0.092841  0.011111      2.000000
  0.046862 -0.092841  0.011111      2.000000
  0.062483 -0.092841  0.011111      2.000000
  0.078104 -0.092841  0.011111      2.000000
  0.093724 -0.092841  0.011111      2.000000
  0.109345 -0.092841  0.011111      2.000000
  0.124966 -0.092841  0.011111      2.000000
 -0.109345 -0.092841  0.011111      2.000000
 -0.093724 -0.092841  0.011111      2.000000
 -0.078104 -0.092841  0.011111      2.000000
 -0.062483 -0.092841  0.011111      2.000000
 -0.046862 -0.092841  0.011111      2.000000
 -0.031241 -0.092841  0.011111      2.000000
 -0.015621 -0.092841  0.011111      2.000000
  0.000000 -0.077367  0.011111      2.000000
  0.015621 -0.077367  0.011111      2.000000
  0.031241 -0.077367  0.011111      2.000000
  0.046862 -0.077367  0.011111      2.000000
  0.062483 -0.077367  0.011111      2.000000
  0.078104 -0.077367  0.011111      2.000000
  0.093724 -0.077367  0.011111      2.000000
  0.109345 -0.077367  0.011111      2.000000
  0.124966 -0.077367  0.011111      2.000000
 -0.109345 -0.077367  0.011111      2.000000
 -0.093724 -0.077367  0.011111      2.000000
 -0.078104 -0.077367  0.011111      2.000000
 -0.062483 -0.077367  0.011111      2.000000
 -0.046862 -0.077367  0.011111      2.000000
 -0.031241 -0.077367  0.011111      2.000000
 -0.015621 -0.077367  0.011111      2.000000
  0.000000 -0.061894  0.011111      2.000000
  0.015621 -0.061894  0.011111      2.000000
  0.031241 -0.061894  0.011111      2.000000
  0.046862 -0.061894  0.011111      2.000000
  0.062483 -0.061894  0.011111      2.000000
  0.078104 -0.061894  0.011111      2.000000
  0.093724 -0.061894  0.011111      2.000000
  0.109345 -0.061894  0.011111      2.000000
  0.124966 -0.061894  0.011111      2.000000
 -0.109345 -0.061894  0.011111      2.000000
 -0.093724 -0.061894  0.011111      2.000000
 -0.078104 -0.061894  0.011111      2.000000
 -0.062483 -0.061894  0.011111      2.000000
 -0.046862 -0.061894  0.011111      2.000000
 -0.031241 -0.061894  0.011111      2.000000
 -0.015621 -0.061894  0.011111      2.000000
  0.000000 -0.046420  0.011111      2.000000
  0.015621 -0.046420  0.011111      2.000000
  0.031241 -0.046420  0.011111      2.000000
  0.046862 -0.046420  0.011111      2.000000
  0.062483 -0.046420  0.011111      2.000000
  0.078104 -0.046420  0.011111      2.000000
  0.093724 -0.046420  0.011111      2.000000
  0.109345 -0.046420  0.011111      2.000000
  0.124966 -0.046420  0.011111      2.000000
 -0.109345 -0.046420  0.011111      2.000000
 -0.093724 -0.046420  0.011111      2.000000
 -0.078104 -0.046420  0.011111      2.000000
 -0.062483 -0.046420  0.011111      2.000000
 -0.046862 -0.046420  0.011111      2.000000
 -0.031241 -0.046420  0.011111      2.000000
 -0.015621 -0.046420  0.011111      2.000000
  0.000000 -0.030947  0.011111      2.000000
  0.015621 -0.030947  0.011111      2.000000
  0.031241 -0.030947  0.011111      2.000000
  0.046862 -0.030947  0.011111      2.000000
  0.062483 -0.030947  0.011111      2.000000
  0.078104 -0.030947  0.011111      2.000000
  0.093724 -0.030947  0.011111      2.000000
  0.109345 -0.030947  0.011111      2.000000
  0.124966 -0.030947  0.011111      2.000000
 -0.109345 -0.030947  0.011111      2.000000
 -0.093724 -0.030947  0.011111      2.000000
 -0.078104 -0.030947  0.011111      2.000000
 -0.062483 -0.030947  0.011111      2.000000
 -0.046862 -0.030947  0.011111      2.000000
 -0.031241 -0.030947  0.011111      2.000000
 -0.015621 -0.030947  0.011111      2.000000
  0.000000 -0.015473  0.011111      2.000000
  0.015621 -0.015473  0.011111      2.000000
  0.031241 -0.015473  0.011111      2.000000
  0.046862 -0.015473  0.011111      2.000000
  0.062483 -0.015473  0.011111      2.000000
  0.078104 -0.015473  0.011111      2.000000
  0.093724 -0.015473  0.011111      2.000000
  0.109345 -0.015473  0.011111      2.000000
  0.124966 -0.015473  0.011111      2.000000
 -0.109345 -0.015473  0.011111      2.000000
 -0.093724 -0.015473  0.011111      2.000000
 -0.078104 -0.015473  0.011111      2.000000
 -0.062483 -0.015473  0.011111      2.000000
 -0.046862 -0.015473  0.011111      2.000000
 -0.031241 -0.015473  0.011111      2.000000
 -0.015621 -0.015473  0.011111      2.000000
 


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




 Dimension of arrays:
   k-points           NKPTS =    361   k-points in BZ     NKDIM =    361   number of bands    NBANDS=     28
   number of dos      NEDOS =    301   number of ions     NIONS =     12
   non local maximal  LDIM  =      4   non local SUM 2l+1 LMDIM =      8
   total plane-waves  NPLWV = 448000
   max r-space proj   IRMAX =      1   max aug-charges    IRDMAX=  10858
   dimension x,y,z NGX =    40 NGY =   40 NGZ =  280
   dimension x,y,z NGXF=    80 NGYF=   80 NGZF=  560
   support grid    NGXF=    80 NGYF=   80 NGZF=  560
   ions per type =               4   4   4
   NGX,Y,Z   is equivalent  to a cutoff of  16.62, 15.43, 15.52 a.u.
   NGXF,Y,Z  is equivalent  to a cutoff of  33.24, 30.87, 31.03 a.u.

 SYSTEM =  local optimisation                      
 POSCAR =  findsym-output                          

 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  =  800.0 eV  58.80 Ry    7.67 a.u.   9.23  9.94 69.19*2*pi/ulx,y,z
   ENINI  =  800.0     initial cutoff
   ENAUG  =  644.9 eV  augmentation charge cutoff
   NELM   =     60;   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   0.00000   0.00000
 Ionic relaxation
   EDIFFG = 0.1E-06   stopping-criterion for IOM
   NSW    =      0    number of steps for IOM
   NBLOCK =      1;   KBLOCK =      1    inner block; outer block 
   IBRION =     -1    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 =     10    prediction:  0-non 1-charg 2-wave 3-comb
   ISYM   =      2    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=  -0.366E-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  1.00 14.00
  Ionic Valenz
   ZVAL   =   4.00  1.00  5.00
  Atomic Wigner-Seitz radii
   RWIGS  =  -1.00 -1.00 -1.00
  virtual crystal weights 
   VCA    =   1.00  1.00  1.00
   NELECT =      40.0000    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  =   0.01  broadening in eV -4-tet -1-fermi 0-gaus

 Electronic relaxation 2 (details)
   IALGO  =     38    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 = 0.0000     energy-eigenvalue tresh-hold
   EBREAK =  0.89E-10  absolut break condition
   DEPER  =   0.30     relativ break condition  

   TIME   =   0.40     timestep for ELM

  volume/ion in A,a.u.               =      43.10       290.83
  Fermi-wavevector in a.u.,A,eV,Ry     =   0.697516  1.318115  6.619631  0.486529
  Thomas-Fermi vector in A             =   1.780865
 
 Write flags
   LWAVE        =      F    write WAVECAR
   LDOWNSAMPLE  =      F    k-point downsampling of WAVECAR
   LCHARG       =      F    write CHGCAR
   LVTOT        =      F    write LOCPOT, total local potential
   LVHAR        =      F    write LOCPOT, Hartree potential only
   LELF         =      F    write electronic localiz. function (ELF)
   LORBIT       =      0    0 simple, 1 ext, 2 COOP (PROOUT), +10 PAW based schemes


 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   =     8    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=     F    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
  (WPLASMAI=    0.000 imaginary part of plasma frequency in eV, 0.658/RTIME)
   DFIELD  = 0.0000000 0.0000000 0.0000000 field for delta impulse in time
 
 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
   LLRAUG    =     F  two centre corrections for induced B field



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


 Static calculation
 charge density and potential will be updated during run
 non-spin polarized calculation
 Variant of blocked Davidson
 Davidson routine will perform the subspace rotation
 perform sub-space diagonalisation
    after 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            8
 reciprocal scheme for non local part
 use partial core corrections
 calculate Harris-corrections to forces 
   (improved forces if not selfconsistent)
 use gradient corrections 
 use of overlap-Matrix (Vanderbilt PP)
 Gauss-broadening in eV      SIGMA  =   0.01


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


  energy-cutoff  :      800.00
  volume of cell :      517.16
      direct lattice vectors                 reciprocal lattice vectors
     4.001094818  0.000000000  0.000000000     0.249931593  0.000000000  0.000000000
     0.000000000  4.308450695  0.000000000     0.000000000  0.232101995  0.000000000
     0.000000000  0.000000000 30.000000000     0.000000000  0.000000000  0.033333333

  length of vectors
     4.001094818  4.308450695 30.000000000     0.249931593  0.232101995  0.033333333


 
 k-points in units of 2pi/SCALE and weight: read from INCAR                         
   0.00000000  0.00000000  0.00000000       0.001
   0.01562072  0.00000000  0.00000000       0.003
   0.03124145  0.00000000  0.00000000       0.003
   0.04686217  0.00000000  0.00000000       0.003
   0.06248290  0.00000000  0.00000000       0.003
   0.07810362  0.00000000  0.00000000       0.003
   0.09372435  0.00000000  0.00000000       0.003
   0.10934507  0.00000000  0.00000000       0.003
   0.12496580  0.00000000  0.00000000       0.001
   0.00000000  0.01547347  0.00000000       0.003
   0.01562072  0.01547347  0.00000000       0.003
   0.03124145  0.01547347  0.00000000       0.003
   0.04686217  0.01547347  0.00000000       0.003
   0.06248290  0.01547347  0.00000000       0.003
   0.07810362  0.01547347  0.00000000       0.003
   0.09372435  0.01547347  0.00000000       0.003
   0.10934507  0.01547347  0.00000000       0.003
   0.12496580  0.01547347  0.00000000       0.003
  -0.10934507  0.01547347  0.00000000       0.003
  -0.09372435  0.01547347  0.00000000       0.003
  -0.07810362  0.01547347  0.00000000       0.003
  -0.06248290  0.01547347  0.00000000       0.003
  -0.04686217  0.01547347  0.00000000       0.003
  -0.03124145  0.01547347  0.00000000       0.003
  -0.01562072  0.01547347  0.00000000       0.003
   0.00000000  0.03094693  0.00000000       0.003
   0.01562072  0.03094693  0.00000000       0.003
   0.03124145  0.03094693  0.00000000       0.003
   0.04686217  0.03094693  0.00000000       0.003
   0.06248290  0.03094693  0.00000000       0.003
   0.07810362  0.03094693  0.00000000       0.003
   0.09372435  0.03094693  0.00000000       0.003
   0.10934507  0.03094693  0.00000000       0.003
   0.12496580  0.03094693  0.00000000       0.003
  -0.10934507  0.03094693  0.00000000       0.003
  -0.09372435  0.03094693  0.00000000       0.003
  -0.07810362  0.03094693  0.00000000       0.003
  -0.06248290  0.03094693  0.00000000       0.003
  -0.04686217  0.03094693  0.00000000       0.003
  -0.03124145  0.03094693  0.00000000       0.003
  -0.01562072  0.03094693  0.00000000       0.003
   0.00000000  0.04642040  0.00000000       0.003
   0.01562072  0.04642040  0.00000000       0.003
   0.03124145  0.04642040  0.00000000       0.003
   0.04686217  0.04642040  0.00000000       0.003
   0.06248290  0.04642040  0.00000000       0.003
   0.07810362  0.04642040  0.00000000       0.003
   0.09372435  0.04642040  0.00000000       0.003
   0.10934507  0.04642040  0.00000000       0.003
   0.12496580  0.04642040  0.00000000       0.003
  -0.10934507  0.04642040  0.00000000       0.003
  -0.09372435  0.04642040  0.00000000       0.003
  -0.07810362  0.04642040  0.00000000       0.003
  -0.06248290  0.04642040  0.00000000       0.003
  -0.04686217  0.04642040  0.00000000       0.003
  -0.03124145  0.04642040  0.00000000       0.003
  -0.01562072  0.04642040  0.00000000       0.003
   0.00000000  0.06189387  0.00000000       0.003
   0.01562072  0.06189387  0.00000000       0.003
   0.03124145  0.06189387  0.00000000       0.003
   0.04686217  0.06189387  0.00000000       0.003
   0.06248290  0.06189387  0.00000000       0.003
   0.07810362  0.06189387  0.00000000       0.003
   0.09372435  0.06189387  0.00000000       0.003
   0.10934507  0.06189387  0.00000000       0.003
   0.12496580  0.06189387  0.00000000       0.003
  -0.10934507  0.06189387  0.00000000       0.003
  -0.09372435  0.06189387  0.00000000       0.003
  -0.07810362  0.06189387  0.00000000       0.003
  -0.06248290  0.06189387  0.00000000       0.003
  -0.04686217  0.06189387  0.00000000       0.003
  -0.03124145  0.06189387  0.00000000       0.003
  -0.01562072  0.06189387  0.00000000       0.003
   0.00000000  0.07736733  0.00000000       0.003
   0.01562072  0.07736733  0.00000000       0.003
   0.03124145  0.07736733  0.00000000       0.003
   0.04686217  0.07736733  0.00000000       0.003
   0.06248290  0.07736733  0.00000000       0.003
   0.07810362  0.07736733  0.00000000       0.003
   0.09372435  0.07736733  0.00000000       0.003
   0.10934507  0.07736733  0.00000000       0.003
   0.12496580  0.07736733  0.00000000       0.003
  -0.10934507  0.07736733  0.00000000       0.003
  -0.09372435  0.07736733  0.00000000       0.003
  -0.07810362  0.07736733  0.00000000       0.003
  -0.06248290  0.07736733  0.00000000       0.003
  -0.04686217  0.07736733  0.00000000       0.003
  -0.03124145  0.07736733  0.00000000       0.003
  -0.01562072  0.07736733  0.00000000       0.003
   0.00000000  0.09284080  0.00000000       0.003
   0.01562072  0.09284080  0.00000000       0.003
   0.03124145  0.09284080  0.00000000       0.003
   0.04686217  0.09284080  0.00000000       0.003
   0.06248290  0.09284080  0.00000000       0.003
   0.07810362  0.09284080  0.00000000       0.003
   0.09372435  0.09284080  0.00000000       0.003
   0.10934507  0.09284080  0.00000000       0.003
   0.12496580  0.09284080  0.00000000       0.003
  -0.10934507  0.09284080  0.00000000       0.003
  -0.09372435  0.09284080  0.00000000       0.003
  -0.07810362  0.09284080  0.00000000       0.003
  -0.06248290  0.09284080  0.00000000       0.003
  -0.04686217  0.09284080  0.00000000       0.003
  -0.03124145  0.09284080  0.00000000       0.003
  -0.01562072  0.09284080  0.00000000       0.003
   0.00000000  0.10831426  0.00000000       0.003
   0.01562072  0.10831426  0.00000000       0.003
   0.03124145  0.10831426  0.00000000       0.003
   0.04686217  0.10831426  0.00000000       0.003
   0.06248290  0.10831426  0.00000000       0.003
   0.07810362  0.10831426  0.00000000       0.003
   0.09372435  0.10831426  0.00000000       0.003
   0.10934507  0.10831426  0.00000000       0.003
   0.12496580  0.10831426  0.00000000       0.003
  -0.10934507  0.10831426  0.00000000       0.003
  -0.09372435  0.10831426  0.00000000       0.003
  -0.07810362  0.10831426  0.00000000       0.003
  -0.06248290  0.10831426  0.00000000       0.003
  -0.04686217  0.10831426  0.00000000       0.003
  -0.03124145  0.10831426  0.00000000       0.003
  -0.01562072  0.10831426  0.00000000       0.003
   0.00000000  0.00000000  0.01111111       0.003
   0.01562072  0.00000000  0.01111111       0.003
   0.03124145  0.00000000  0.01111111       0.003
   0.04686217  0.00000000  0.01111111       0.003
   0.06248290  0.00000000  0.01111111       0.003
   0.07810362  0.00000000  0.01111111       0.003
   0.09372435  0.00000000  0.01111111       0.003
   0.10934507  0.00000000  0.01111111       0.003
   0.12496580  0.00000000  0.01111111       0.003
  -0.10934507  0.00000000  0.01111111       0.003
  -0.09372435  0.00000000  0.01111111       0.003
  -0.07810362  0.00000000  0.01111111       0.003
  -0.06248290  0.00000000  0.01111111       0.003
  -0.04686217  0.00000000  0.01111111       0.003
  -0.03124145  0.00000000  0.01111111       0.003
  -0.01562072  0.00000000  0.01111111       0.003
   0.00000000  0.01547347  0.01111111       0.003
   0.01562072  0.01547347  0.01111111       0.003
   0.03124145  0.01547347  0.01111111       0.003
   0.04686217  0.01547347  0.01111111       0.003
   0.06248290  0.01547347  0.01111111       0.003
   0.07810362  0.01547347  0.01111111       0.003
   0.09372435  0.01547347  0.01111111       0.003
   0.10934507  0.01547347  0.01111111       0.003
   0.12496580  0.01547347  0.01111111       0.003
  -0.10934507  0.01547347  0.01111111       0.003
  -0.09372435  0.01547347  0.01111111       0.003
  -0.07810362  0.01547347  0.01111111       0.003
  -0.06248290  0.01547347  0.01111111       0.003
  -0.04686217  0.01547347  0.01111111       0.003
  -0.03124145  0.01547347  0.01111111       0.003
  -0.01562072  0.01547347  0.01111111       0.003
   0.00000000  0.03094693  0.01111111       0.003
   0.01562072  0.03094693  0.01111111       0.003
   0.03124145  0.03094693  0.01111111       0.003
   0.04686217  0.03094693  0.01111111       0.003
   0.06248290  0.03094693  0.01111111       0.003
   0.07810362  0.03094693  0.01111111       0.003
   0.09372435  0.03094693  0.01111111       0.003
   0.10934507  0.03094693  0.01111111       0.003
   0.12496580  0.03094693  0.01111111       0.003
  -0.10934507  0.03094693  0.01111111       0.003
  -0.09372435  0.03094693  0.01111111       0.003
  -0.07810362  0.03094693  0.01111111       0.003
  -0.06248290  0.03094693  0.01111111       0.003
  -0.04686217  0.03094693  0.01111111       0.003
  -0.03124145  0.03094693  0.01111111       0.003
  -0.01562072  0.03094693  0.01111111       0.003
   0.00000000  0.04642040  0.01111111       0.003
   0.01562072  0.04642040  0.01111111       0.003
   0.03124145  0.04642040  0.01111111       0.003
   0.04686217  0.04642040  0.01111111       0.003
   0.06248290  0.04642040  0.01111111       0.003
   0.07810362  0.04642040  0.01111111       0.003
   0.09372435  0.04642040  0.01111111       0.003
   0.10934507  0.04642040  0.01111111       0.003
   0.12496580  0.04642040  0.01111111       0.003
  -0.10934507  0.04642040  0.01111111       0.003
  -0.09372435  0.04642040  0.01111111       0.003
  -0.07810362  0.04642040  0.01111111       0.003
  -0.06248290  0.04642040  0.01111111       0.003
  -0.04686217  0.04642040  0.01111111       0.003
  -0.03124145  0.04642040  0.01111111       0.003
  -0.01562072  0.04642040  0.01111111       0.003
   0.00000000  0.06189387  0.01111111       0.003
   0.01562072  0.06189387  0.01111111       0.003
   0.03124145  0.06189387  0.01111111       0.003
   0.04686217  0.06189387  0.01111111       0.003
   0.06248290  0.06189387  0.01111111       0.003
   0.07810362  0.06189387  0.01111111       0.003
   0.09372435  0.06189387  0.01111111       0.003
   0.10934507  0.06189387  0.01111111       0.003
   0.12496580  0.06189387  0.01111111       0.003
  -0.10934507  0.06189387  0.01111111       0.003
  -0.09372435  0.06189387  0.01111111       0.003
  -0.07810362  0.06189387  0.01111111       0.003
  -0.06248290  0.06189387  0.01111111       0.003
  -0.04686217  0.06189387  0.01111111       0.003
  -0.03124145  0.06189387  0.01111111       0.003
  -0.01562072  0.06189387  0.01111111       0.003
   0.00000000  0.07736733  0.01111111       0.003
   0.01562072  0.07736733  0.01111111       0.003
   0.03124145  0.07736733  0.01111111       0.003
   0.04686217  0.07736733  0.01111111       0.003
   0.06248290  0.07736733  0.01111111       0.003
   0.07810362  0.07736733  0.01111111       0.003
   0.09372435  0.07736733  0.01111111       0.003
   0.10934507  0.07736733  0.01111111       0.003
   0.12496580  0.07736733  0.01111111       0.003
  -0.10934507  0.07736733  0.01111111       0.003
  -0.09372435  0.07736733  0.01111111       0.003
  -0.07810362  0.07736733  0.01111111       0.003
  -0.06248290  0.07736733  0.01111111       0.003
  -0.04686217  0.07736733  0.01111111       0.003
  -0.03124145  0.07736733  0.01111111       0.003
  -0.01562072  0.07736733  0.01111111       0.003
   0.00000000  0.09284080  0.01111111       0.003
   0.01562072  0.09284080  0.01111111       0.003
   0.03124145  0.09284080  0.01111111       0.003
   0.04686217  0.09284080  0.01111111       0.003
   0.06248290  0.09284080  0.01111111       0.003
   0.07810362  0.09284080  0.01111111       0.003
   0.09372435  0.09284080  0.01111111       0.003
   0.10934507  0.09284080  0.01111111       0.003
   0.12496580  0.09284080  0.01111111       0.003
  -0.10934507  0.09284080  0.01111111       0.003
  -0.09372435  0.09284080  0.01111111       0.003
  -0.07810362  0.09284080  0.01111111       0.003
  -0.06248290  0.09284080  0.01111111       0.003
  -0.04686217  0.09284080  0.01111111       0.003
  -0.03124145  0.09284080  0.01111111       0.003
  -0.01562072  0.09284080  0.01111111       0.003
   0.00000000  0.10831426  0.01111111       0.003
   0.01562072  0.10831426  0.01111111       0.003
   0.03124145  0.10831426  0.01111111       0.003
   0.04686217  0.10831426  0.01111111       0.003
   0.06248290  0.10831426  0.01111111       0.003
   0.07810362  0.10831426  0.01111111       0.003
   0.09372435  0.10831426  0.01111111       0.003
   0.10934507  0.10831426  0.01111111       0.003
   0.12496580  0.10831426  0.01111111       0.003
  -0.10934507  0.10831426  0.01111111       0.003
  -0.09372435  0.10831426  0.01111111       0.003
  -0.07810362  0.10831426  0.01111111       0.003
  -0.06248290  0.10831426  0.01111111       0.003
  -0.04686217  0.10831426  0.01111111       0.003
  -0.03124145  0.10831426  0.01111111       0.003
  -0.01562072  0.10831426  0.01111111       0.003
   0.00000000 -0.10831426  0.01111111       0.003
   0.01562072 -0.10831426  0.01111111       0.003
   0.03124145 -0.10831426  0.01111111       0.003
   0.04686217 -0.10831426  0.01111111       0.003
   0.06248290 -0.10831426  0.01111111       0.003
   0.07810362 -0.10831426  0.01111111       0.003
   0.09372435 -0.10831426  0.01111111       0.003
   0.10934507 -0.10831426  0.01111111       0.003
   0.12496580 -0.10831426  0.01111111       0.003
  -0.10934507 -0.10831426  0.01111111       0.003
  -0.09372435 -0.10831426  0.01111111       0.003
  -0.07810362 -0.10831426  0.01111111       0.003
  -0.06248290 -0.10831426  0.01111111       0.003
  -0.04686217 -0.10831426  0.01111111       0.003
  -0.03124145 -0.10831426  0.01111111       0.003
  -0.01562072 -0.10831426  0.01111111       0.003
   0.00000000 -0.09284080  0.01111111       0.003
   0.01562072 -0.09284080  0.01111111       0.003
   0.03124145 -0.09284080  0.01111111       0.003
   0.04686217 -0.09284080  0.01111111       0.003
   0.06248290 -0.09284080  0.01111111       0.003
   0.07810362 -0.09284080  0.01111111       0.003
   0.09372435 -0.09284080  0.01111111       0.003
   0.10934507 -0.09284080  0.01111111       0.003
   0.12496580 -0.09284080  0.01111111       0.003
  -0.10934507 -0.09284080  0.01111111       0.003
  -0.09372435 -0.09284080  0.01111111       0.003
  -0.07810362 -0.09284080  0.01111111       0.003
  -0.06248290 -0.09284080  0.01111111       0.003
  -0.04686217 -0.09284080  0.01111111       0.003
  -0.03124145 -0.09284080  0.01111111       0.003
  -0.01562072 -0.09284080  0.01111111       0.003
   0.00000000 -0.07736733  0.01111111       0.003
   0.01562072 -0.07736733  0.01111111       0.003
   0.03124145 -0.07736733  0.01111111       0.003
   0.04686217 -0.07736733  0.01111111       0.003
   0.06248290 -0.07736733  0.01111111       0.003
   0.07810362 -0.07736733  0.01111111       0.003
   0.09372435 -0.07736733  0.01111111       0.003
   0.10934507 -0.07736733  0.01111111       0.003
   0.12496580 -0.07736733  0.01111111       0.003
  -0.10934507 -0.07736733  0.01111111       0.003
  -0.09372435 -0.07736733  0.01111111       0.003
  -0.07810362 -0.07736733  0.01111111       0.003
  -0.06248290 -0.07736733  0.01111111       0.003
  -0.04686217 -0.07736733  0.01111111       0.003
  -0.03124145 -0.07736733  0.01111111       0.003
  -0.01562072 -0.07736733  0.01111111       0.003
   0.00000000 -0.06189387  0.01111111       0.003
   0.01562072 -0.06189387  0.01111111       0.003
   0.03124145 -0.06189387  0.01111111       0.003
   0.04686217 -0.06189387  0.01111111       0.003
   0.06248290 -0.06189387  0.01111111       0.003
   0.07810362 -0.06189387  0.01111111       0.003
   0.09372435 -0.06189387  0.01111111       0.003
   0.10934507 -0.06189387  0.01111111       0.003
   0.12496580 -0.06189387  0.01111111       0.003
  -0.10934507 -0.06189387  0.01111111       0.003
  -0.09372435 -0.06189387  0.01111111       0.003
  -0.07810362 -0.06189387  0.01111111       0.003
  -0.06248290 -0.06189387  0.01111111       0.003
  -0.04686217 -0.06189387  0.01111111       0.003
  -0.03124145 -0.06189387  0.01111111       0.003
  -0.01562072 -0.06189387  0.01111111       0.003
   0.00000000 -0.04642040  0.01111111       0.003
   0.01562072 -0.04642040  0.01111111       0.003
   0.03124145 -0.04642040  0.01111111       0.003
   0.04686217 -0.04642040  0.01111111       0.003
   0.06248290 -0.04642040  0.01111111       0.003
   0.07810362 -0.04642040  0.01111111       0.003
   0.09372435 -0.04642040  0.01111111       0.003
   0.10934507 -0.04642040  0.01111111       0.003
   0.12496580 -0.04642040  0.01111111       0.003
  -0.10934507 -0.04642040  0.01111111       0.003
  -0.09372435 -0.04642040  0.01111111       0.003
  -0.07810362 -0.04642040  0.01111111       0.003
  -0.06248290 -0.04642040  0.01111111       0.003
  -0.04686217 -0.04642040  0.01111111       0.003
  -0.03124145 -0.04642040  0.01111111       0.003
  -0.01562072 -0.04642040  0.01111111       0.003
   0.00000000 -0.03094693  0.01111111       0.003
   0.01562072 -0.03094693  0.01111111       0.003
   0.03124145 -0.03094693  0.01111111       0.003
   0.04686217 -0.03094693  0.01111111       0.003
   0.06248290 -0.03094693  0.01111111       0.003
   0.07810362 -0.03094693  0.01111111       0.003
   0.09372435 -0.03094693  0.01111111       0.003
   0.10934507 -0.03094693  0.01111111       0.003
   0.12496580 -0.03094693  0.01111111       0.003
  -0.10934507 -0.03094693  0.01111111       0.003
  -0.09372435 -0.03094693  0.01111111       0.003
  -0.07810362 -0.03094693  0.01111111       0.003
  -0.06248290 -0.03094693  0.01111111       0.003
  -0.04686217 -0.03094693  0.01111111       0.003
  -0.03124145 -0.03094693  0.01111111       0.003
  -0.01562072 -0.03094693  0.01111111       0.003
   0.00000000 -0.01547347  0.01111111       0.003
   0.01562072 -0.01547347  0.01111111       0.003
   0.03124145 -0.01547347  0.01111111       0.003
   0.04686217 -0.01547347  0.01111111       0.003
   0.06248290 -0.01547347  0.01111111       0.003
   0.07810362 -0.01547347  0.01111111       0.003
   0.09372435 -0.01547347  0.01111111       0.003
   0.10934507 -0.01547347  0.01111111       0.003
   0.12496580 -0.01547347  0.01111111       0.003
  -0.10934507 -0.01547347  0.01111111       0.003
  -0.09372435 -0.01547347  0.01111111       0.003
  -0.07810362 -0.01547347  0.01111111       0.003
  -0.06248290 -0.01547347  0.01111111       0.003
  -0.04686217 -0.01547347  0.01111111       0.003
  -0.03124145 -0.01547347  0.01111111       0.003
  -0.01562072 -0.01547347  0.01111111       0.003
 
 k-points in reciprocal lattice and weights: read from INCAR                         
   0.00000000  0.00000000  0.00000000       0.001
   0.06250000  0.00000000  0.00000000       0.003
   0.12500000  0.00000000  0.00000000       0.003
   0.18750000  0.00000000  0.00000000       0.003
   0.25000000  0.00000000  0.00000000       0.003
   0.31250000  0.00000000  0.00000000       0.003
   0.37500000  0.00000000  0.00000000       0.003
   0.43750000  0.00000000  0.00000000       0.003
   0.50000000  0.00000000  0.00000000       0.001
   0.00000000  0.06666667  0.00000000       0.003
   0.06250000  0.06666667  0.00000000       0.003
   0.12500000  0.06666667  0.00000000       0.003
   0.18750000  0.06666667  0.00000000       0.003
   0.25000000  0.06666667  0.00000000       0.003
   0.31250000  0.06666667  0.00000000       0.003
   0.37500000  0.06666667  0.00000000       0.003
   0.43750000  0.06666667  0.00000000       0.003
   0.50000000  0.06666667  0.00000000       0.003
  -0.43750000  0.06666667  0.00000000       0.003
  -0.37500000  0.06666667  0.00000000       0.003
  -0.31250000  0.06666667  0.00000000       0.003
  -0.25000000  0.06666667  0.00000000       0.003
  -0.18750000  0.06666667  0.00000000       0.003
  -0.12500000  0.06666667  0.00000000       0.003
  -0.06250000  0.06666667  0.00000000       0.003
   0.00000000  0.13333333  0.00000000       0.003
   0.06250000  0.13333333  0.00000000       0.003
   0.12500000  0.13333333  0.00000000       0.003
   0.18750000  0.13333333  0.00000000       0.003
   0.25000000  0.13333333  0.00000000       0.003
   0.31250000  0.13333333  0.00000000       0.003
   0.37500000  0.13333333  0.00000000       0.003
   0.43750000  0.13333333  0.00000000       0.003
   0.50000000  0.13333333  0.00000000       0.003
  -0.43750000  0.13333333  0.00000000       0.003
  -0.37500000  0.13333333  0.00000000       0.003
  -0.31250000  0.13333333  0.00000000       0.003
  -0.25000000  0.13333333  0.00000000       0.003
  -0.18750000  0.13333333  0.00000000       0.003
  -0.12500000  0.13333333  0.00000000       0.003
  -0.06250000  0.13333333  0.00000000       0.003
   0.00000000  0.20000000  0.00000000       0.003
   0.06250000  0.20000000  0.00000000       0.003
   0.12500000  0.20000000  0.00000000       0.003
   0.18750000  0.20000000  0.00000000       0.003
   0.25000000  0.20000000  0.00000000       0.003
   0.31250000  0.20000000  0.00000000       0.003
   0.37500000  0.20000000  0.00000000       0.003
   0.43750000  0.20000000  0.00000000       0.003
   0.50000000  0.20000000  0.00000000       0.003
  -0.43750000  0.20000000  0.00000000       0.003
  -0.37500000  0.20000000  0.00000000       0.003
  -0.31250000  0.20000000  0.00000000       0.003
  -0.25000000  0.20000000  0.00000000       0.003
  -0.18750000  0.20000000  0.00000000       0.003
  -0.12500000  0.20000000  0.00000000       0.003
  -0.06250000  0.20000000  0.00000000       0.003
   0.00000000  0.26666667  0.00000000       0.003
   0.06250000  0.26666667  0.00000000       0.003
   0.12500000  0.26666667  0.00000000       0.003
   0.18750000  0.26666667  0.00000000       0.003
   0.25000000  0.26666667  0.00000000       0.003
   0.31250000  0.26666667  0.00000000       0.003
   0.37500000  0.26666667  0.00000000       0.003
   0.43750000  0.26666667  0.00000000       0.003
   0.50000000  0.26666667  0.00000000       0.003
  -0.43750000  0.26666667  0.00000000       0.003
  -0.37500000  0.26666667  0.00000000       0.003
  -0.31250000  0.26666667  0.00000000       0.003
  -0.25000000  0.26666667  0.00000000       0.003
  -0.18750000  0.26666667  0.00000000       0.003
  -0.12500000  0.26666667  0.00000000       0.003
  -0.06250000  0.26666667  0.00000000       0.003
   0.00000000  0.33333333  0.00000000       0.003
   0.06250000  0.33333333  0.00000000       0.003
   0.12500000  0.33333333  0.00000000       0.003
   0.18750000  0.33333333  0.00000000       0.003
   0.25000000  0.33333333  0.00000000       0.003
   0.31250000  0.33333333  0.00000000       0.003
   0.37500000  0.33333333  0.00000000       0.003
   0.43750000  0.33333333  0.00000000       0.003
   0.50000000  0.33333333  0.00000000       0.003
  -0.43750000  0.33333333  0.00000000       0.003
  -0.37500000  0.33333333  0.00000000       0.003
  -0.31250000  0.33333333  0.00000000       0.003
  -0.25000000  0.33333333  0.00000000       0.003
  -0.18750000  0.33333333  0.00000000       0.003
  -0.12500000  0.33333333  0.00000000       0.003
  -0.06250000  0.33333333  0.00000000       0.003
   0.00000000  0.40000000  0.00000000       0.003
   0.06250000  0.40000000  0.00000000       0.003
   0.12500000  0.40000000  0.00000000       0.003
   0.18750000  0.40000000  0.00000000       0.003
   0.25000000  0.40000000  0.00000000       0.003
   0.31250000  0.40000000  0.00000000       0.003
   0.37500000  0.40000000  0.00000000       0.003
   0.43750000  0.40000000  0.00000000       0.003
   0.50000000  0.40000000  0.00000000       0.003
  -0.43750000  0.40000000  0.00000000       0.003
  -0.37500000  0.40000000  0.00000000       0.003
  -0.31250000  0.40000000  0.00000000       0.003
  -0.25000000  0.40000000  0.00000000       0.003
  -0.18750000  0.40000000  0.00000000       0.003
  -0.12500000  0.40000000  0.00000000       0.003
  -0.06250000  0.40000000  0.00000000       0.003
   0.00000000  0.46666667  0.00000000       0.003
   0.06250000  0.46666667  0.00000000       0.003
   0.12500000  0.46666667  0.00000000       0.003
   0.18750000  0.46666667  0.00000000       0.003
   0.25000000  0.46666667  0.00000000       0.003
   0.31250000  0.46666667  0.00000000       0.003
   0.37500000  0.46666667  0.00000000       0.003
   0.43750000  0.46666667  0.00000000       0.003
   0.50000000  0.46666667  0.00000000       0.003
  -0.43750000  0.46666667  0.00000000       0.003
  -0.37500000  0.46666667  0.00000000       0.003
  -0.31250000  0.46666667  0.00000000       0.003
  -0.25000000  0.46666667  0.00000000       0.003
  -0.18750000  0.46666667  0.00000000       0.003
  -0.12500000  0.46666667  0.00000000       0.003
  -0.06250000  0.46666667  0.00000000       0.003
   0.00000000  0.00000000  0.33333333       0.003
   0.06250000  0.00000000  0.33333333       0.003
   0.12500000  0.00000000  0.33333333       0.003
   0.18750000  0.00000000  0.33333333       0.003
   0.25000000  0.00000000  0.33333333       0.003
   0.31250000  0.00000000  0.33333333       0.003
   0.37500000  0.00000000  0.33333333       0.003
   0.43750000  0.00000000  0.33333333       0.003
   0.50000000  0.00000000  0.33333333       0.003
  -0.43750000  0.00000000  0.33333333       0.003
  -0.37500000  0.00000000  0.33333333       0.003
  -0.31250000  0.00000000  0.33333333       0.003
  -0.25000000  0.00000000  0.33333333       0.003
  -0.18750000  0.00000000  0.33333333       0.003
  -0.12500000  0.00000000  0.33333333       0.003
  -0.06250000  0.00000000  0.33333333       0.003
   0.00000000  0.06666667  0.33333333       0.003
   0.06250000  0.06666667  0.33333333       0.003
   0.12500000  0.06666667  0.33333333       0.003
   0.18750000  0.06666667  0.33333333       0.003
   0.25000000  0.06666667  0.33333333       0.003
   0.31250000  0.06666667  0.33333333       0.003
   0.37500000  0.06666667  0.33333333       0.003
   0.43750000  0.06666667  0.33333333       0.003
   0.50000000  0.06666667  0.33333333       0.003
  -0.43750000  0.06666667  0.33333333       0.003
  -0.37500000  0.06666667  0.33333333       0.003
  -0.31250000  0.06666667  0.33333333       0.003
  -0.25000000  0.06666667  0.33333333       0.003
  -0.18750000  0.06666667  0.33333333       0.003
  -0.12500000  0.06666667  0.33333333       0.003
  -0.06250000  0.06666667  0.33333333       0.003
   0.00000000  0.13333333  0.33333333       0.003
   0.06250000  0.13333333  0.33333333       0.003
   0.12500000  0.13333333  0.33333333       0.003
   0.18750000  0.13333333  0.33333333       0.003
   0.25000000  0.13333333  0.33333333       0.003
   0.31250000  0.13333333  0.33333333       0.003
   0.37500000  0.13333333  0.33333333       0.003
   0.43750000  0.13333333  0.33333333       0.003
   0.50000000  0.13333333  0.33333333       0.003
  -0.43750000  0.13333333  0.33333333       0.003
  -0.37500000  0.13333333  0.33333333       0.003
  -0.31250000  0.13333333  0.33333333       0.003
  -0.25000000  0.13333333  0.33333333       0.003
  -0.18750000  0.13333333  0.33333333       0.003
  -0.12500000  0.13333333  0.33333333       0.003
  -0.06250000  0.13333333  0.33333333       0.003
   0.00000000  0.20000000  0.33333333       0.003
   0.06250000  0.20000000  0.33333333       0.003
   0.12500000  0.20000000  0.33333333       0.003
   0.18750000  0.20000000  0.33333333       0.003
   0.25000000  0.20000000  0.33333333       0.003
   0.31250000  0.20000000  0.33333333       0.003
   0.37500000  0.20000000  0.33333333       0.003
   0.43750000  0.20000000  0.33333333       0.003
   0.50000000  0.20000000  0.33333333       0.003
  -0.43750000  0.20000000  0.33333333       0.003
  -0.37500000  0.20000000  0.33333333       0.003
  -0.31250000  0.20000000  0.33333333       0.003
  -0.25000000  0.20000000  0.33333333       0.003
  -0.18750000  0.20000000  0.33333333       0.003
  -0.12500000  0.20000000  0.33333333       0.003
  -0.06250000  0.20000000  0.33333333       0.003
   0.00000000  0.26666667  0.33333333       0.003
   0.06250000  0.26666667  0.33333333       0.003
   0.12500000  0.26666667  0.33333333       0.003
   0.18750000  0.26666667  0.33333333       0.003
   0.25000000  0.26666667  0.33333333       0.003
   0.31250000  0.26666667  0.33333333       0.003
   0.37500000  0.26666667  0.33333333       0.003
   0.43750000  0.26666667  0.33333333       0.003
   0.50000000  0.26666667  0.33333333       0.003
  -0.43750000  0.26666667  0.33333333       0.003
  -0.37500000  0.26666667  0.33333333       0.003
  -0.31250000  0.26666667  0.33333333       0.003
  -0.25000000  0.26666667  0.33333333       0.003
  -0.18750000  0.26666667  0.33333333       0.003
  -0.12500000  0.26666667  0.33333333       0.003
  -0.06250000  0.26666667  0.33333333       0.003
   0.00000000  0.33333333  0.33333333       0.003
   0.06250000  0.33333333  0.33333333       0.003
   0.12500000  0.33333333  0.33333333       0.003
   0.18750000  0.33333333  0.33333333       0.003
   0.25000000  0.33333333  0.33333333       0.003
   0.31250000  0.33333333  0.33333333       0.003
   0.37500000  0.33333333  0.33333333       0.003
   0.43750000  0.33333333  0.33333333       0.003
   0.50000000  0.33333333  0.33333333       0.003
  -0.43750000  0.33333333  0.33333333       0.003
  -0.37500000  0.33333333  0.33333333       0.003
  -0.31250000  0.33333333  0.33333333       0.003
  -0.25000000  0.33333333  0.33333333       0.003
  -0.18750000  0.33333333  0.33333333       0.003
  -0.12500000  0.33333333  0.33333333       0.003
  -0.06250000  0.33333333  0.33333333       0.003
   0.00000000  0.40000000  0.33333333       0.003
   0.06250000  0.40000000  0.33333333       0.003
   0.12500000  0.40000000  0.33333333       0.003
   0.18750000  0.40000000  0.33333333       0.003
   0.25000000  0.40000000  0.33333333       0.003
   0.31250000  0.40000000  0.33333333       0.003
   0.37500000  0.40000000  0.33333333       0.003
   0.43750000  0.40000000  0.33333333       0.003
   0.50000000  0.40000000  0.33333333       0.003
  -0.43750000  0.40000000  0.33333333       0.003
  -0.37500000  0.40000000  0.33333333       0.003
  -0.31250000  0.40000000  0.33333333       0.003
  -0.25000000  0.40000000  0.33333333       0.003
  -0.18750000  0.40000000  0.33333333       0.003
  -0.12500000  0.40000000  0.33333333       0.003
  -0.06250000  0.40000000  0.33333333       0.003
   0.00000000  0.46666667  0.33333333       0.003
   0.06250000  0.46666667  0.33333333       0.003
   0.12500000  0.46666667  0.33333333       0.003
   0.18750000  0.46666667  0.33333333       0.003
   0.25000000  0.46666667  0.33333333       0.003
   0.31250000  0.46666667  0.33333333       0.003
   0.37500000  0.46666667  0.33333333       0.003
   0.43750000  0.46666667  0.33333333       0.003
   0.50000000  0.46666667  0.33333333       0.003
  -0.43750000  0.46666667  0.33333333       0.003
  -0.37500000  0.46666667  0.33333333       0.003
  -0.31250000  0.46666667  0.33333333       0.003
  -0.25000000  0.46666667  0.33333333       0.003
  -0.18750000  0.46666667  0.33333333       0.003
  -0.12500000  0.46666667  0.33333333       0.003
  -0.06250000  0.46666667  0.33333333       0.003
   0.00000000 -0.46666667  0.33333333       0.003
   0.06250000 -0.46666667  0.33333333       0.003
   0.12500000 -0.46666667  0.33333333       0.003
   0.18750000 -0.46666667  0.33333333       0.003
   0.25000000 -0.46666667  0.33333333       0.003
   0.31250000 -0.46666667  0.33333333       0.003
   0.37500000 -0.46666667  0.33333333       0.003
   0.43750000 -0.46666667  0.33333333       0.003
   0.50000000 -0.46666667  0.33333333       0.003
  -0.43750000 -0.46666667  0.33333333       0.003
  -0.37500000 -0.46666667  0.33333333       0.003
  -0.31250000 -0.46666667  0.33333333       0.003
  -0.25000000 -0.46666667  0.33333333       0.003
  -0.18750000 -0.46666667  0.33333333       0.003
  -0.12500000 -0.46666667  0.33333333       0.003
  -0.06250000 -0.46666667  0.33333333       0.003
   0.00000000 -0.40000000  0.33333333       0.003
   0.06250000 -0.40000000  0.33333333       0.003
   0.12500000 -0.40000000  0.33333333       0.003
   0.18750000 -0.40000000  0.33333333       0.003
   0.25000000 -0.40000000  0.33333333       0.003
   0.31250000 -0.40000000  0.33333333       0.003
   0.37500000 -0.40000000  0.33333333       0.003
   0.43750000 -0.40000000  0.33333333       0.003
   0.50000000 -0.40000000  0.33333333       0.003
  -0.43750000 -0.40000000  0.33333333       0.003
  -0.37500000 -0.40000000  0.33333333       0.003
  -0.31250000 -0.40000000  0.33333333       0.003
  -0.25000000 -0.40000000  0.33333333       0.003
  -0.18750000 -0.40000000  0.33333333       0.003
  -0.12500000 -0.40000000  0.33333333       0.003
  -0.06250000 -0.40000000  0.33333333       0.003
   0.00000000 -0.33333333  0.33333333       0.003
   0.06250000 -0.33333333  0.33333333       0.003
   0.12500000 -0.33333333  0.33333333       0.003
   0.18750000 -0.33333333  0.33333333       0.003
   0.25000000 -0.33333333  0.33333333       0.003
   0.31250000 -0.33333333  0.33333333       0.003
   0.37500000 -0.33333333  0.33333333       0.003
   0.43750000 -0.33333333  0.33333333       0.003
   0.50000000 -0.33333333  0.33333333       0.003
  -0.43750000 -0.33333333  0.33333333       0.003
  -0.37500000 -0.33333333  0.33333333       0.003
  -0.31250000 -0.33333333  0.33333333       0.003
  -0.25000000 -0.33333333  0.33333333       0.003
  -0.18750000 -0.33333333  0.33333333       0.003
  -0.12500000 -0.33333333  0.33333333       0.003
  -0.06250000 -0.33333333  0.33333333       0.003
   0.00000000 -0.26666667  0.33333333       0.003
   0.06250000 -0.26666667  0.33333333       0.003
   0.12500000 -0.26666667  0.33333333       0.003
   0.18750000 -0.26666667  0.33333333       0.003
   0.25000000 -0.26666667  0.33333333       0.003
   0.31250000 -0.26666667  0.33333333       0.003
   0.37500000 -0.26666667  0.33333333       0.003
   0.43750000 -0.26666667  0.33333333       0.003
   0.50000000 -0.26666667  0.33333333       0.003
  -0.43750000 -0.26666667  0.33333333       0.003
  -0.37500000 -0.26666667  0.33333333       0.003
  -0.31250000 -0.26666667  0.33333333       0.003
  -0.25000000 -0.26666667  0.33333333       0.003
  -0.18750000 -0.26666667  0.33333333       0.003
  -0.12500000 -0.26666667  0.33333333       0.003
  -0.06250000 -0.26666667  0.33333333       0.003
   0.00000000 -0.20000000  0.33333333       0.003
   0.06250000 -0.20000000  0.33333333       0.003
   0.12500000 -0.20000000  0.33333333       0.003
   0.18750000 -0.20000000  0.33333333       0.003
   0.25000000 -0.20000000  0.33333333       0.003
   0.31250000 -0.20000000  0.33333333       0.003
   0.37500000 -0.20000000  0.33333333       0.003
   0.43750000 -0.20000000  0.33333333       0.003
   0.50000000 -0.20000000  0.33333333       0.003
  -0.43750000 -0.20000000  0.33333333       0.003
  -0.37500000 -0.20000000  0.33333333       0.003
  -0.31250000 -0.20000000  0.33333333       0.003
  -0.25000000 -0.20000000  0.33333333       0.003
  -0.18750000 -0.20000000  0.33333333       0.003
  -0.12500000 -0.20000000  0.33333333       0.003
  -0.06250000 -0.20000000  0.33333333       0.003
   0.00000000 -0.13333333  0.33333333       0.003
   0.06250000 -0.13333333  0.33333333       0.003
   0.12500000 -0.13333333  0.33333333       0.003
   0.18750000 -0.13333333  0.33333333       0.003
   0.25000000 -0.13333333  0.33333333       0.003
   0.31250000 -0.13333333  0.33333333       0.003
   0.37500000 -0.13333333  0.33333333       0.003
   0.43750000 -0.13333333  0.33333333       0.003
   0.50000000 -0.13333333  0.33333333       0.003
  -0.43750000 -0.13333333  0.33333333       0.003
  -0.37500000 -0.13333333  0.33333333       0.003
  -0.31250000 -0.13333333  0.33333333       0.003
  -0.25000000 -0.13333333  0.33333333       0.003
  -0.18750000 -0.13333333  0.33333333       0.003
  -0.12500000 -0.13333333  0.33333333       0.003
  -0.06250000 -0.13333333  0.33333333       0.003
   0.00000000 -0.06666667  0.33333333       0.003
   0.06250000 -0.06666667  0.33333333       0.003
   0.12500000 -0.06666667  0.33333333       0.003
   0.18750000 -0.06666667  0.33333333       0.003
   0.25000000 -0.06666667  0.33333333       0.003
   0.31250000 -0.06666667  0.33333333       0.003
   0.37500000 -0.06666667  0.33333333       0.003
   0.43750000 -0.06666667  0.33333333       0.003
   0.50000000 -0.06666667  0.33333333       0.003
  -0.43750000 -0.06666667  0.33333333       0.003
  -0.37500000 -0.06666667  0.33333333       0.003
  -0.31250000 -0.06666667  0.33333333       0.003
  -0.25000000 -0.06666667  0.33333333       0.003
  -0.18750000 -0.06666667  0.33333333       0.003
  -0.12500000 -0.06666667  0.33333333       0.003
  -0.06250000 -0.06666667  0.33333333       0.003
 
 position of ions in fractional coordinates (direct lattice) 
   0.57638799  0.89975267  0.98413050
   0.07647857  0.07627614  0.02432077
   0.57643398  0.39973604  0.02431133
   0.07637035  0.57629277  0.98409597
   0.65264712  0.99912273  0.95117790
   0.15310085  0.97729601  0.05730163
   0.65288155  0.49900118  0.05727493
   0.15244607  0.47729268  0.95110257
   0.20865589  0.88985398  0.98681207
   0.70874626  0.08612980  0.02164707
   0.20872537  0.38984478  0.02160153
   0.70864354  0.58614898  0.98679793
 
 position of ions in cartesian coordinates  (Angst):
   2.30618300  3.87654000 29.52391500
   0.30599800  0.32863200  0.72962300
   2.30636700  1.72224300  0.72934000
   0.30556500  2.48292900 29.52287900
   2.61130300  4.30467100 28.53533700
   0.61257100  4.21063170  1.71904900
   2.61224100  2.14992200  1.71824800
   0.60995118  2.05639200 28.53307700
   0.83485200  3.83389200 29.60436200
   2.83576100  0.37108600  0.64941200
   0.83513000  1.67962700  0.64804600
   2.83535000  2.52539400 29.60393800
 


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


 k-point  1 :   0.0000 0.0000 0.0000  plane waves:   26527
 k-point  2 :   0.0625 0.0000 0.0000  plane waves:   26539
 k-point  3 :   0.1250 0.0000 0.0000  plane waves:   26547
 k-point  4 :   0.1875 0.0000 0.0000  plane waves:   26533
 k-point  5 :   0.2500 0.0000 0.0000  plane waves:   26540
 k-point  6 :   0.3125 0.0000 0.0000  plane waves:   26538
 k-point  7 :   0.3750 0.0000 0.0000  plane waves:   26512
 k-point  8 :   0.4375 0.0000 0.0000  plane waves:   26480
 k-point  9 :   0.5000 0.0000 0.0000  plane waves:   26462
 k-point 10 :   0.0000 0.0667 0.0000  plane waves:   26568
 k-point 11 :   0.0625 0.0667 0.0000  plane waves:   26545
 k-point 12 :   0.1250 0.0667 0.0000  plane waves:   26551
 k-point 13 :   0.1875 0.0667 0.0000  plane waves:   26524
 k-point 14 :   0.2500 0.0667 0.0000  plane waves:   26534
 k-point 15 :   0.3125 0.0667 0.0000  plane waves:   26535
 k-point 16 :   0.3750 0.0667 0.0000  plane waves:   26515
 k-point 17 :   0.4375 0.0667 0.0000  plane waves:   26497
 k-point 18 :   0.5000 0.0667 0.0000  plane waves:   26494
 k-point 19 :  -0.4375 0.0667 0.0000  plane waves:   26497
 k-point 20 :  -0.3750 0.0667 0.0000  plane waves:   26515
 k-point 21 :  -0.3125 0.0667 0.0000  plane waves:   26535
 k-point 22 :  -0.2500 0.0667 0.0000  plane waves:   26534
 k-point 23 :  -0.1875 0.0667 0.0000  plane waves:   26524
 k-point 24 :  -0.1250 0.0667 0.0000  plane waves:   26551
 k-point 25 :  -0.0625 0.0667 0.0000  plane waves:   26545
 k-point 26 :   0.0000 0.1333 0.0000  plane waves:   26600
 k-point 27 :   0.0625 0.1333 0.0000  plane waves:   26564
 k-point 28 :   0.1250 0.1333 0.0000  plane waves:   26581
 k-point 29 :   0.1875 0.1333 0.0000  plane waves:   26548
 k-point 30 :   0.2500 0.1333 0.0000  plane waves:   26535
 k-point 31 :   0.3125 0.1333 0.0000  plane waves:   26539
 k-point 32 :   0.3750 0.1333 0.0000  plane waves:   26530
 k-point 33 :   0.4375 0.1333 0.0000  plane waves:   26534
 k-point 34 :   0.5000 0.1333 0.0000  plane waves:   26534
 k-point 35 :  -0.4375 0.1333 0.0000  plane waves:   26534
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 k-point ** :   0.0625-0.0667 0.3333  plane waves:   26530
 k-point ** :   0.1250-0.0667 0.3333  plane waves:   26553
 k-point ** :   0.1875-0.0667 0.3333  plane waves:   26523
 k-point ** :   0.2500-0.0667 0.3333  plane waves:   26539
 k-point ** :   0.3125-0.0667 0.3333  plane waves:   26534
 k-point ** :   0.3750-0.0667 0.3333  plane waves:   26524
 k-point ** :   0.4375-0.0667 0.3333  plane waves:   26498
 k-point ** :   0.5000-0.0667 0.3333  plane waves:   26482
 k-point ** :  -0.4375-0.0667 0.3333  plane waves:   26498
 k-point ** :  -0.3750-0.0667 0.3333  plane waves:   26524
 k-point ** :  -0.3125-0.0667 0.3333  plane waves:   26534
 k-point ** :  -0.2500-0.0667 0.3333  plane waves:   26539
 k-point ** :  -0.1875-0.0667 0.3333  plane waves:   26523
 k-point ** :  -0.1250-0.0667 0.3333  plane waves:   26553
 k-point ** :  -0.0625-0.0667 0.3333  plane waves:   26530

 maximum and minimum number of plane-waves per node :      3376     3284

 maximum number of plane-waves:     26706
 maximum index in each direction: 
   IXMAX=    9   IYMAX=   10   IZMAX=   69
   IXMIN=   -9   IYMIN=  -10   IZMIN=  -69


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


 total amount of memory used by VASP MPI-rank0   561509. kBytes
=======================================================================

   base      :      30000. kBytes
   nonl-proj :     233116. kBytes
   fftplans  :       9259. kBytes
   grid      :      16617. kBytes
   one-center:          6. kBytes
   wavefun   :     272511. kBytes
 
     INWAV:  cpu time    0.0001: real time    0.0003
 Broyden mixing: mesh for mixing (old mesh)
   NGX = 19   NGY = 19   NGZ =139
  (NGX  = 80   NGY  = 80   NGZ  =560)
  gives a total of  50179 points

 initial charge density was supplied:
 charge density of overlapping atoms calculated
 number of electron      40.0000000 magnetization 
 keeping initial charge density in first step


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


 Maximum index for augmentation-charges          748 (set IRDMAX)


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


 First call to EWALD:  gamma=   0.221
 Maximum number of real-space cells 5x 5x 1
 Maximum number of reciprocal cells 2x 2x 9

    FEWALD:  cpu time    0.0075: real time    0.0076


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


    POTLOK:  cpu time    0.1323: real time    0.1393
    SETDIJ:  cpu time    0.0010: real time    0.0011
     EDDAV:  cpu time   21.7229: real time   21.7940
       DOS:  cpu time    0.0057: real time    0.0058
    --------------------------------------------
      LOOP:  cpu time   21.8619: real time   21.9402

 eigenvalue-minimisations  : 20408
 total energy-change (2. order) : 0.4480407E+03  (-0.1699301E+04)
 number of electron      40.0000000 magnetization 
 augmentation part       40.0000000 magnetization 

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        13.77443636
  Ewald energy   TEWEN  =     15846.66529757
  -Hartree energ DENC   =    -17136.67279601
  -exchange      EXHF   =         0.00000000
  -V(xc)+E(xc)   XCENC  =       144.55577484
  PAW double counting   =      1262.35522171    -1269.43229245
  entropy T*S    EENTRO =        -0.00022280
  eigenvalues    EBANDS =      -109.95799017
  atomic energy  EATOM  =      1696.75323255
  Solvation  Ediel_sol  =         0.00000000
  ---------------------------------------------------
  free energy    TOTEN  =       448.04066161 eV

  energy without entropy =      448.04088441  energy(sigma->0) =      448.04077301


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




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


     EDDAV:  cpu time   30.9809: real time   31.0791
       DOS:  cpu time    0.0022: real time    0.0022
    --------------------------------------------
      LOOP:  cpu time   30.9831: real time   31.0814

 eigenvalue-minimisations  : 32908
 total energy-change (2. order) :-0.4452790E+03  (-0.4276619E+03)
 number of electron      40.0000000 magnetization 
 augmentation part       40.0000000 magnetization 

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        13.77443636
  Ewald energy   TEWEN  =     15846.66529757
  -Hartree energ DENC   =    -17136.67279601
  -exchange      EXHF   =         0.00000000
  -V(xc)+E(xc)   XCENC  =       144.55577484
  PAW double counting   =      1262.35522171    -1269.43229245
  entropy T*S    EENTRO =        -0.00000000
  eigenvalues    EBANDS =      -555.23725518
  atomic energy  EATOM  =      1696.75323255
  Solvation  Ediel_sol  =         0.00000000
  ---------------------------------------------------
  free energy    TOTEN  =         2.76161940 eV

  energy without entropy =        2.76161940  energy(sigma->0) =        2.76161940


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




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


     EDDAV:  cpu time   23.7799: real time   23.8601
       DOS:  cpu time    0.0017: real time    0.0017
    --------------------------------------------
      LOOP:  cpu time   23.7815: real time   23.8617

 eigenvalue-minimisations  : 23232
 total energy-change (2. order) :-0.8583041E+02  (-0.8560297E+02)
 number of electron      40.0000000 magnetization 
 augmentation part       40.0000000 magnetization 

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        13.77443636
  Ewald energy   TEWEN  =     15846.66529757
  -Hartree energ DENC   =    -17136.67279601
  -exchange      EXHF   =         0.00000000
  -V(xc)+E(xc)   XCENC  =       144.55577484
  PAW double counting   =      1262.35522171    -1269.43229245
  entropy T*S    EENTRO =        -0.00000000
  eigenvalues    EBANDS =      -641.06766829
  atomic energy  EATOM  =      1696.75323255
  Solvation  Ediel_sol  =         0.00000000
  ---------------------------------------------------
  free energy    TOTEN  =       -83.06879371 eV

  energy without entropy =      -83.06879371  energy(sigma->0) =      -83.06879371


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




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


     EDDAV:  cpu time   28.1939: real time   28.2983
       DOS:  cpu time    0.0017: real time    0.0017
    --------------------------------------------
      LOOP:  cpu time   28.1956: real time   28.3000

 eigenvalue-minimisations  : 29144
 total energy-change (2. order) :-0.3181767E+01  (-0.3171793E+01)
 number of electron      40.0000000 magnetization 
 augmentation part       40.0000000 magnetization 

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        13.77443636
  Ewald energy   TEWEN  =     15846.66529757
  -Hartree energ DENC   =    -17136.67279601
  -exchange      EXHF   =         0.00000000
  -V(xc)+E(xc)   XCENC  =       144.55577484
  PAW double counting   =      1262.35522171    -1269.43229245
  entropy T*S    EENTRO =        -0.00000000
  eigenvalues    EBANDS =      -644.24943553
  atomic energy  EATOM  =      1696.75323255
  Solvation  Ediel_sol  =         0.00000000
  ---------------------------------------------------
  free energy    TOTEN  =       -86.25056096 eV

  energy without entropy =      -86.25056096  energy(sigma->0) =      -86.25056096


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




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


     EDDAV:  cpu time   29.2845: real time   29.5558
       DOS:  cpu time    0.0016: real time    0.0016
    CHARGE:  cpu time    1.1360: real time    1.1390
    MIXING:  cpu time    0.0061: real time    0.0063
    --------------------------------------------
      LOOP:  cpu time   30.4283: real time   30.7027

 eigenvalue-minimisations  : 30712
 total energy-change (2. order) :-0.6482119E-01  (-0.6470595E-01)
 number of electron      40.0000000 magnetization 
 augmentation part        1.5581822 magnetization 

 Broyden mixing:
  rms(total) = 0.14704E+01    rms(broyden)= 0.14704E+01
  rms(prec ) = 0.15080E+01
  weight for this iteration     100.00

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        13.77443636
  Ewald energy   TEWEN  =     15846.66529757
  -Hartree energ DENC   =    -17136.67279601
  -exchange      EXHF   =         0.00000000
  -V(xc)+E(xc)   XCENC  =       144.55577484
  PAW double counting   =      1262.35522171    -1269.43229245
  entropy T*S    EENTRO =        -0.00000000
  eigenvalues    EBANDS =      -644.31425673
  atomic energy  EATOM  =      1696.75323255
  Solvation  Ediel_sol  =         0.00000000
  ---------------------------------------------------
  free energy    TOTEN  =       -86.31538215 eV

  energy without entropy =      -86.31538215  energy(sigma->0) =      -86.31538215


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




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


    POTLOK:  cpu time    0.1101: real time    0.1105
    SETDIJ:  cpu time    0.0023: real time    0.0023
     EDDAV:  cpu time   27.4044: real time   27.4788
       DOS:  cpu time    0.0016: real time    0.0016
    CHARGE:  cpu time    1.1407: real time    1.1436
    MIXING:  cpu time    0.0062: real time    0.0064
    --------------------------------------------
      LOOP:  cpu time   28.6654: real time   28.7432

 eigenvalue-minimisations  : 28252
 total energy-change (2. order) : 0.3371438E+01  (-0.6234525E+00)
 number of electron      40.0000000 magnetization 
 augmentation part        1.4290937 magnetization 

 Broyden mixing:
  rms(total) = 0.77778E+00    rms(broyden)= 0.77778E+00
  rms(prec ) = 0.79344E+00
  weight for this iteration     100.00

 eigenvalues of (default mixing * dielectric matrix)
  average eigenvalue GAMMA=   1.6526
  1.6526

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        13.77443636
  Ewald energy   TEWEN  =     15846.66529757
  -Hartree energ DENC   =    -17190.08531428
  -exchange      EXHF   =         0.00000000
  -V(xc)+E(xc)   XCENC  =       147.21708201
  PAW double counting   =      1984.74238147    -1992.60224559
  entropy T*S    EENTRO =        -0.00000000
  eigenvalues    EBANDS =      -589.40881472
  atomic energy  EATOM  =      1696.75323255
  Solvation  Ediel_sol  =         0.00000000
  ---------------------------------------------------
  free energy    TOTEN  =       -82.94394462 eV

  energy without entropy =      -82.94394462  energy(sigma->0) =      -82.94394462


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




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


    POTLOK:  cpu time    0.1088: real time    0.1092
    SETDIJ:  cpu time    0.0023: real time    0.0023
     EDDAV:  cpu time   26.6201: real time   26.7005
       DOS:  cpu time    0.0017: real time    0.0017
    CHARGE:  cpu time    1.1348: real time    1.1380
    MIXING:  cpu time    0.0056: real time    0.0056
    --------------------------------------------
      LOOP:  cpu time   27.8733: real time   27.9573

 eigenvalue-minimisations  : 26928
 total energy-change (2. order) : 0.7991554E+00  (-0.1523115E+00)
 number of electron      40.0000000 magnetization 
 augmentation part        1.3944193 magnetization 

 Broyden mixing:
  rms(total) = 0.30454E+00    rms(broyden)= 0.30453E+00
  rms(prec ) = 0.30946E+00
  weight for this iteration     100.00

 eigenvalues of (default mixing * dielectric matrix)
  average eigenvalue GAMMA=   1.8093
  1.2214  2.3972

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        13.77443636
  Ewald energy   TEWEN  =     15846.66529757
  -Hartree energ DENC   =    -17232.44653319
  -exchange      EXHF   =         0.00000000
  -V(xc)+E(xc)   XCENC  =       149.22071658
  PAW double counting   =      2900.23754781    -2908.64929721
  entropy T*S    EENTRO =        -0.00000000
  eigenvalues    EBANDS =      -547.70018969
  atomic energy  EATOM  =      1696.75323255
  Solvation  Ediel_sol  =         0.00000000
  ---------------------------------------------------
  free energy    TOTEN  =       -82.14478921 eV

  energy without entropy =      -82.14478921  energy(sigma->0) =      -82.14478921


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




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


    POTLOK:  cpu time    0.1076: real time    0.1082
    SETDIJ:  cpu time    0.0022: real time    0.0022
     EDDAV:  cpu time   27.4542: real time   27.5581
       DOS:  cpu time    0.0016: real time    0.0016
    CHARGE:  cpu time    1.1395: real time    1.1424
    MIXING:  cpu time    0.0058: real time    0.0059
    --------------------------------------------
      LOOP:  cpu time   28.7109: real time   28.8183

 eigenvalue-minimisations  : 28176
 total energy-change (2. order) : 0.7760126E-01  (-0.2358430E-01)
 number of electron      40.0000000 magnetization 
 augmentation part        1.3958526 magnetization 

 Broyden mixing:
  rms(total) = 0.77204E-01    rms(broyden)= 0.77204E-01
  rms(prec ) = 0.81067E-01
  weight for this iteration     100.00

 eigenvalues of (default mixing * dielectric matrix)
  average eigenvalue GAMMA=   1.7422
  1.1652  2.3202  1.7411

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        13.77443636
  Ewald energy   TEWEN  =     15846.66529757
  -Hartree energ DENC   =    -17252.85342672
  -exchange      EXHF   =         0.00000000
  -V(xc)+E(xc)   XCENC  =       149.96281541
  PAW double counting   =      3466.33373321    -3474.92555525
  entropy T*S    EENTRO =        -0.00000000
  eigenvalues    EBANDS =      -527.77772110
  atomic energy  EATOM  =      1696.75323255
  Solvation  Ediel_sol  =         0.00000000
  ---------------------------------------------------
  free energy    TOTEN  =       -82.06718795 eV

  energy without entropy =      -82.06718795  energy(sigma->0) =      -82.06718795


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




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


    POTLOK:  cpu time    0.1092: real time    0.1097
    SETDIJ:  cpu time    0.0010: real time    0.0010
     EDDAV:  cpu time   26.8056: real time   27.0467
       DOS:  cpu time    0.0015: real time    0.0015
    CHARGE:  cpu time    1.1369: real time    1.1398
    MIXING:  cpu time    0.0066: real time    0.0066
    --------------------------------------------
      LOOP:  cpu time   28.0609: real time   28.3054

 eigenvalue-minimisations  : 27516
 total energy-change (2. order) : 0.1072167E-01  (-0.3187426E-02)
 number of electron      40.0000000 magnetization 
 augmentation part        1.3941997 magnetization 

 Broyden mixing:
  rms(total) = 0.20250E-01    rms(broyden)= 0.20249E-01
  rms(prec ) = 0.26225E-01
  weight for this iteration     100.00

 eigenvalues of (default mixing * dielectric matrix)
  average eigenvalue GAMMA=   1.6587
  2.4711  1.1089  1.1089  1.9457

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        13.77443636
  Ewald energy   TEWEN  =     15846.66529757
  -Hartree energ DENC   =    -17258.45047632
  -exchange      EXHF   =         0.00000000
  -V(xc)+E(xc)   XCENC  =       149.95082230
  PAW double counting   =      3508.62667943    -3517.18701190
  entropy T*S    EENTRO =        -0.00000000
  eigenvalues    EBANDS =      -522.18944628
  atomic energy  EATOM  =      1696.75323255
  Solvation  Ediel_sol  =         0.00000000
  ---------------------------------------------------
  free energy    TOTEN  =       -82.05646628 eV

  energy without entropy =      -82.05646628  energy(sigma->0) =      -82.05646628


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




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


    POTLOK:  cpu time    0.1085: real time    0.1089
    SETDIJ:  cpu time    0.0033: real time    0.0033
     EDDAV:  cpu time   28.3631: real time   28.4655
       DOS:  cpu time    0.0017: real time    0.0018
    CHARGE:  cpu time    1.1431: real time    1.1461
    MIXING:  cpu time    0.0062: real time    0.0062
    --------------------------------------------
      LOOP:  cpu time   29.6259: real time   29.7317

 eigenvalue-minimisations  : 29260
 total energy-change (2. order) : 0.3854580E-02  (-0.2727376E-03)
 number of electron      40.0000000 magnetization 
 augmentation part        1.3938337 magnetization 

 Broyden mixing:
  rms(total) = 0.11252E-01    rms(broyden)= 0.11252E-01
  rms(prec ) = 0.17266E-01
  weight for this iteration     100.00

 eigenvalues of (default mixing * dielectric matrix)
  average eigenvalue GAMMA=   1.6864
  2.3200  2.3200  1.0457  1.3733  1.3733

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        13.77443636
  Ewald energy   TEWEN  =     15846.66529757
  -Hartree energ DENC   =    -17263.46038325
  -exchange      EXHF   =         0.00000000
  -V(xc)+E(xc)   XCENC  =       149.99358077
  PAW double counting   =      3533.57654058    -3542.13354322
  entropy T*S    EENTRO =        -0.00000000
  eigenvalues    EBANDS =      -517.22177306
  atomic energy  EATOM  =      1696.75323255
  Solvation  Ediel_sol  =         0.00000000
  ---------------------------------------------------
  free energy    TOTEN  =       -82.05261170 eV

  energy without entropy =      -82.05261170  energy(sigma->0) =      -82.05261170


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




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


    POTLOK:  cpu time    0.1096: real time    0.1101
    SETDIJ:  cpu time    0.0012: real time    0.0012
     EDDAV:  cpu time   26.0833: real time   26.1765
       DOS:  cpu time    0.0017: real time    0.0017
    CHARGE:  cpu time    1.1376: real time    1.1407
    MIXING:  cpu time    0.0067: real time    0.0067
    --------------------------------------------
      LOOP:  cpu time   27.3400: real time   27.4369

 eigenvalue-minimisations  : 26532
 total energy-change (2. order) : 0.1974542E-02  (-0.3613413E-03)
 number of electron      40.0000000 magnetization 
 augmentation part        1.3942984 magnetization 

 Broyden mixing:
  rms(total) = 0.87337E-02    rms(broyden)= 0.87336E-02
  rms(prec ) = 0.12120E-01
  weight for this iteration     100.00

 eigenvalues of (default mixing * dielectric matrix)
  average eigenvalue GAMMA=   1.7577
  3.1290  2.5517  1.7183  1.0446  1.0513  1.0513

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        13.77443636
  Ewald energy   TEWEN  =     15846.66529757
  -Hartree energ DENC   =    -17270.45266100
  -exchange      EXHF   =         0.00000000
  -V(xc)+E(xc)   XCENC  =       150.01908263
  PAW double counting   =      3520.01491777    -3528.56607485
  entropy T*S    EENTRO =        -0.00000000
  eigenvalues    EBANDS =      -510.25886819
  atomic energy  EATOM  =      1696.75323255
  Solvation  Ediel_sol  =         0.00000000
  ---------------------------------------------------
  free energy    TOTEN  =       -82.05063716 eV

  energy without entropy =      -82.05063716  energy(sigma->0) =      -82.05063716


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




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


    POTLOK:  cpu time    0.1090: real time    0.1094
    SETDIJ:  cpu time    0.0034: real time    0.0034
     EDDAV:  cpu time   26.2682: real time   26.4895
       DOS:  cpu time    0.0017: real time    0.0017
    CHARGE:  cpu time    1.1392: real time    1.1423
    MIXING:  cpu time    0.0063: real time    0.0064
    --------------------------------------------
      LOOP:  cpu time   27.5278: real time   27.7527

 eigenvalue-minimisations  : 26644
 total energy-change (2. order) : 0.2505294E-03  (-0.1749442E-03)
 number of electron      40.0000000 magnetization 
 augmentation part        1.3928960 magnetization 

 Broyden mixing:
  rms(total) = 0.44458E-02    rms(broyden)= 0.44457E-02
  rms(prec ) = 0.65087E-02
  weight for this iteration     100.00

 eigenvalues of (default mixing * dielectric matrix)
  average eigenvalue GAMMA=   1.9451
  3.9170  2.6851  1.9035  1.9035  0.9500  1.1282  1.1282

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        13.77443636
  Ewald energy   TEWEN  =     15846.66529757
  -Hartree energ DENC   =    -17276.31521546
  -exchange      EXHF   =         0.00000000
  -V(xc)+E(xc)   XCENC  =       150.06074157
  PAW double counting   =      3524.42090402    -3532.97158331
  entropy T*S    EENTRO =        -0.00000000
  eigenvalues    EBANDS =      -504.43819994
  atomic energy  EATOM  =      1696.75323255
  Solvation  Ediel_sol  =         0.00000000
  ---------------------------------------------------
  free energy    TOTEN  =       -82.05038663 eV

  energy without entropy =      -82.05038663  energy(sigma->0) =      -82.05038663


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




--------------------------------------- Iteration      1(  13)  ---------------------------------------


    POTLOK:  cpu time    0.1103: real time    0.1110
    SETDIJ:  cpu time    0.0011: real time    0.0011
     EDDAV:  cpu time   24.5876: real time   24.6607
       DOS:  cpu time    0.0017: real time    0.0017
    CHARGE:  cpu time    1.1335: real time    1.1368
    MIXING:  cpu time    0.0073: real time    0.0073
    --------------------------------------------
      LOOP:  cpu time   25.8415: real time   25.9185

 eigenvalue-minimisations  : 24532
 total energy-change (2. order) :-0.1455773E-02  (-0.5686088E-04)
 number of electron      40.0000000 magnetization 
 augmentation part        1.3926317 magnetization 

 Broyden mixing:
  rms(total) = 0.33134E-02    rms(broyden)= 0.33134E-02
  rms(prec ) = 0.40717E-02
  weight for this iteration     100.00

 eigenvalues of (default mixing * dielectric matrix)
  average eigenvalue GAMMA=   2.0410
  5.3844  2.4498  2.4498  1.7110  0.9380  1.1695  1.1126  1.1126

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        13.77443636
  Ewald energy   TEWEN  =     15846.66529757
  -Hartree energ DENC   =    -17280.36543025
  -exchange      EXHF   =         0.00000000
  -V(xc)+E(xc)   XCENC  =       150.06487789
  PAW double counting   =      3520.25498745    -3528.80255347
  entropy T*S    EENTRO =        -0.00000000
  eigenvalues    EBANDS =      -500.39669050
  atomic energy  EATOM  =      1696.75323255
  Solvation  Ediel_sol  =         0.00000000
  ---------------------------------------------------
  free energy    TOTEN  =       -82.05184240 eV

  energy without entropy =      -82.05184240  energy(sigma->0) =      -82.05184240


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




--------------------------------------- Iteration      1(  14)  ---------------------------------------


    POTLOK:  cpu time    0.1100: real time    0.1105
    SETDIJ:  cpu time    0.0030: real time    0.0030
     EDDAV:  cpu time   25.2610: real time   25.3334
       DOS:  cpu time    0.0017: real time    0.0017
    CHARGE:  cpu time    1.1389: real time    1.1421
    MIXING:  cpu time    0.0067: real time    0.0067
    --------------------------------------------
      LOOP:  cpu time   26.5213: real time   26.5974

 eigenvalue-minimisations  : 25236
 total energy-change (2. order) :-0.6944899E-03  (-0.1629299E-04)
 number of electron      40.0000000 magnetization 
 augmentation part        1.3926897 magnetization 

 Broyden mixing:
  rms(total) = 0.14747E-02    rms(broyden)= 0.14747E-02
  rms(prec ) = 0.19956E-02
  weight for this iteration     100.00

 eigenvalues of (default mixing * dielectric matrix)
  average eigenvalue GAMMA=   2.2255
  6.5798  3.0411  2.3513  2.1990  1.4831  1.1614  1.1614  0.9546  1.0973

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        13.77443636
  Ewald energy   TEWEN  =     15846.66529757
  -Hartree energ DENC   =    -17282.26034220
  -exchange      EXHF   =         0.00000000
  -V(xc)+E(xc)   XCENC  =       150.07048891
  PAW double counting   =      3520.59573478    -3529.14459980
  entropy T*S    EENTRO =        -0.00000000
  eigenvalues    EBANDS =      -498.50678506
  atomic energy  EATOM  =      1696.75323255
  Solvation  Ediel_sol  =         0.00000000
  ---------------------------------------------------
  free energy    TOTEN  =       -82.05253689 eV

  energy without entropy =      -82.05253689  energy(sigma->0) =      -82.05253689


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




--------------------------------------- Iteration      1(  15)  ---------------------------------------


    POTLOK:  cpu time    0.1093: real time    0.1099
    SETDIJ:  cpu time    0.0014: real time    0.0014
     EDDAV:  cpu time   23.6976: real time   23.7627
       DOS:  cpu time    0.0018: real time    0.0018
    CHARGE:  cpu time    1.1339: real time    1.1369
    MIXING:  cpu time    0.0075: real time    0.0076
    --------------------------------------------
      LOOP:  cpu time   24.9517: real time   25.0203

 eigenvalue-minimisations  : 23232
 total energy-change (2. order) :-0.8585945E-03  (-0.1021223E-04)
 number of electron      40.0000000 magnetization 
 augmentation part        1.3927238 magnetization 

 Broyden mixing:
  rms(total) = 0.84515E-03    rms(broyden)= 0.84515E-03
  rms(prec ) = 0.10431E-02
  weight for this iteration     100.00

 eigenvalues of (default mixing * dielectric matrix)
  average eigenvalue GAMMA=   2.2313
  7.2130  3.3642  2.5075  2.0357  1.7171  1.1557  1.1557  1.2247  0.9542  0.9858

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        13.77443636
  Ewald energy   TEWEN  =     15846.66529757
  -Hartree energ DENC   =    -17283.27727521
  -exchange      EXHF   =         0.00000000
  -V(xc)+E(xc)   XCENC  =       150.06720544
  PAW double counting   =      3520.34900762    -3528.89845638
  entropy T*S    EENTRO =        -0.00000000
  eigenvalues    EBANDS =      -497.48684344
  atomic energy  EATOM  =      1696.75323255
  Solvation  Ediel_sol  =         0.00000000
  ---------------------------------------------------
  free energy    TOTEN  =       -82.05339548 eV

  energy without entropy =      -82.05339548  energy(sigma->0) =      -82.05339548


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




--------------------------------------- Iteration      1(  16)  ---------------------------------------


    POTLOK:  cpu time    0.1076: real time    0.1081
    SETDIJ:  cpu time    0.0038: real time    0.0038
     EDDAV:  cpu time   24.2886: real time   24.3596
       DOS:  cpu time    0.0017: real time    0.0017
    CHARGE:  cpu time    1.1291: real time    1.1319
    MIXING:  cpu time    0.0067: real time    0.0067
    --------------------------------------------
      LOOP:  cpu time   25.5375: real time   25.6118

 eigenvalue-minimisations  : 24156
 total energy-change (2. order) :-0.3591916E-03  (-0.2284722E-05)
 number of electron      40.0000000 magnetization 
 augmentation part        1.3926822 magnetization 

 Broyden mixing:
  rms(total) = 0.63816E-03    rms(broyden)= 0.63815E-03
  rms(prec ) = 0.75228E-03
  weight for this iteration     100.00

 eigenvalues of (default mixing * dielectric matrix)
  average eigenvalue GAMMA=   2.3966
  7.8250  4.3558  2.6083  2.6083  2.0581  1.5787  1.1537  1.1537  1.0982  1.0026
  0.9205

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        13.77443636
  Ewald energy   TEWEN  =     15846.66529757
  -Hartree energ DENC   =    -17283.55261435
  -exchange      EXHF   =         0.00000000
  -V(xc)+E(xc)   XCENC  =       150.06817973
  PAW double counting   =      3520.80568205    -3529.35517936
  entropy T*S    EENTRO =        -0.00000000
  eigenvalues    EBANDS =      -497.21278922
  atomic energy  EATOM  =      1696.75323255
  Solvation  Ediel_sol  =         0.00000000
  ---------------------------------------------------
  free energy    TOTEN  =       -82.05375468 eV

  energy without entropy =      -82.05375468  energy(sigma->0) =      -82.05375468


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




--------------------------------------- Iteration      1(  17)  ---------------------------------------


    POTLOK:  cpu time    0.1064: real time    0.1071
    SETDIJ:  cpu time    0.0027: real time    0.0027
     EDDAV:  cpu time   22.6641: real time   22.7519
       DOS:  cpu time    0.0017: real time    0.0017
    CHARGE:  cpu time    1.1379: real time    1.1408
    MIXING:  cpu time    0.0177: real time    0.0178
    --------------------------------------------
      LOOP:  cpu time   23.9305: real time   24.0219

 eigenvalue-minimisations  : 21960
 total energy-change (2. order) :-0.3461075E-03  (-0.6440299E-05)
 number of electron      40.0000000 magnetization 
 augmentation part        1.3926175 magnetization 

 Broyden mixing:
  rms(total) = 0.46087E-03    rms(broyden)= 0.46086E-03
  rms(prec ) = 0.49689E-03
  weight for this iteration     100.00

 eigenvalues of (default mixing * dielectric matrix)
  average eigenvalue GAMMA=   2.3930
  7.9195  5.0393  2.7909  2.5708  1.7615  1.6585  1.6585  1.1655  1.1655  0.9404
  1.0227  1.0227

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        13.77443636
  Ewald energy   TEWEN  =     15846.66529757
  -Hartree energ DENC   =    -17283.69483076
  -exchange      EXHF   =         0.00000000
  -V(xc)+E(xc)   XCENC  =       150.06786404
  PAW double counting   =      3520.79829759    -3529.34704333
  entropy T*S    EENTRO =        -0.00000000
  eigenvalues    EBANDS =      -497.07135481
  atomic energy  EATOM  =      1696.75323255
  Solvation  Ediel_sol  =         0.00000000
  ---------------------------------------------------
  free energy    TOTEN  =       -82.05410078 eV

  energy without entropy =      -82.05410078  energy(sigma->0) =      -82.05410078


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




--------------------------------------- Iteration      1(  18)  ---------------------------------------


    POTLOK:  cpu time    0.1083: real time    0.1088
    SETDIJ:  cpu time    0.0078: real time    0.0078
     EDDAV:  cpu time   25.0633: real time   25.1469
       DOS:  cpu time    0.0017: real time    0.0017
    CHARGE:  cpu time    1.1181: real time    1.2671
    MIXING:  cpu time    0.0082: real time    0.0082
    --------------------------------------------
      LOOP:  cpu time   26.3073: real time   26.5405

 eigenvalue-minimisations  : 25312
 total energy-change (2. order) :-0.5392447E-04  (-0.6316083E-06)
 number of electron      40.0000000 magnetization 
 augmentation part        1.3926656 magnetization 

 Broyden mixing:
  rms(total) = 0.14574E-03    rms(broyden)= 0.14574E-03
  rms(prec ) = 0.18558E-03
  weight for this iteration     100.00

 eigenvalues of (default mixing * dielectric matrix)
  average eigenvalue GAMMA=   2.3908
  8.1825  5.3008  2.9299  2.5954  2.0983  2.0983  1.3984  1.1916  1.1916  0.9598
  0.9598  1.0874  1.0874

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        13.77443636
  Ewald energy   TEWEN  =     15846.66529757
  -Hartree energ DENC   =    -17283.75515993
  -exchange      EXHF   =         0.00000000
  -V(xc)+E(xc)   XCENC  =       150.06758642
  PAW double counting   =      3520.70785535    -3529.25684104
  entropy T*S    EENTRO =        -0.00000000
  eigenvalues    EBANDS =      -497.01056199
  atomic energy  EATOM  =      1696.75323255
  Solvation  Ediel_sol  =         0.00000000
  ---------------------------------------------------
  free energy    TOTEN  =       -82.05415471 eV

  energy without entropy =      -82.05415471  energy(sigma->0) =      -82.05415471


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




--------------------------------------- Iteration      1(  19)  ---------------------------------------


    POTLOK:  cpu time    0.1102: real time    0.1107
    SETDIJ:  cpu time    0.0014: real time    0.0014
     EDDAV:  cpu time   23.3101: real time   23.3880
       DOS:  cpu time    0.0017: real time    0.0017
    CHARGE:  cpu time    1.1249: real time    1.1277
    MIXING:  cpu time    0.0081: real time    0.0082
    --------------------------------------------
      LOOP:  cpu time   24.5564: real time   24.6377

 eigenvalue-minimisations  : 22764
 total energy-change (2. order) :-0.4417482E-04  (-0.3807096E-06)
 number of electron      40.0000000 magnetization 
 augmentation part        1.3926546 magnetization 

 Broyden mixing:
  rms(total) = 0.68251E-04    rms(broyden)= 0.68251E-04
  rms(prec ) = 0.97045E-04
  weight for this iteration     100.00

 eigenvalues of (default mixing * dielectric matrix)
  average eigenvalue GAMMA=   2.3869
  8.0329  5.9336  3.0600  2.7371  2.5757  1.8807  1.5949  1.2007  1.2007  0.9438
  1.0112  1.0947  1.0756  1.0756

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        13.77443636
  Ewald energy   TEWEN  =     15846.66529757
  -Hartree energ DENC   =    -17283.77153780
  -exchange      EXHF   =         0.00000000
  -V(xc)+E(xc)   XCENC  =       150.06727009
  PAW double counting   =      3520.68598338    -3529.23498609
  entropy T*S    EENTRO =        -0.00000000
  eigenvalues    EBANDS =      -496.99389495
  atomic energy  EATOM  =      1696.75323255
  Solvation  Ediel_sol  =         0.00000000
  ---------------------------------------------------
  free energy    TOTEN  =       -82.05419888 eV

  energy without entropy =      -82.05419888  energy(sigma->0) =      -82.05419888


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




--------------------------------------- Iteration      1(  20)  ---------------------------------------


    POTLOK:  cpu time    0.1098: real time    0.1104
    SETDIJ:  cpu time    0.0013: real time    0.0013
     EDDAV:  cpu time   23.2708: real time   23.3491
       DOS:  cpu time    0.0017: real time    0.0017
    CHARGE:  cpu time    1.1215: real time    1.1243
    MIXING:  cpu time    0.0088: real time    0.0088
    --------------------------------------------
      LOOP:  cpu time   24.5137: real time   24.5955

 eigenvalue-minimisations  : 22620
 total energy-change (2. order) :-0.1783848E-04  (-0.9280497E-07)
 number of electron      40.0000000 magnetization 
 augmentation part        1.3926543 magnetization 

 Broyden mixing:
  rms(total) = 0.51895E-04    rms(broyden)= 0.51895E-04
  rms(prec ) = 0.68101E-04
  weight for this iteration     100.00

 eigenvalues of (default mixing * dielectric matrix)
  average eigenvalue GAMMA=   2.4294
  8.1377  6.3702  3.8265  2.8242  2.4102  1.9778  1.9778  1.4081  1.1986  1.1986
  1.1101  1.1101  0.9482  0.9714  0.9714

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        13.77443636
  Ewald energy   TEWEN  =     15846.66529757
  -Hartree energ DENC   =    -17283.80054035
  -exchange      EXHF   =         0.00000000
  -V(xc)+E(xc)   XCENC  =       150.06736219
  PAW double counting   =      3520.68947161    -3529.23853391
  entropy T*S    EENTRO =        -0.00000000
  eigenvalues    EBANDS =      -496.96494274
  atomic energy  EATOM  =      1696.75323255
  Solvation  Ediel_sol  =         0.00000000
  ---------------------------------------------------
  free energy    TOTEN  =       -82.05421672 eV

  energy without entropy =      -82.05421672  energy(sigma->0) =      -82.05421672


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




--------------------------------------- Iteration      1(  21)  ---------------------------------------


    POTLOK:  cpu time    0.1085: real time    0.1089
    SETDIJ:  cpu time    0.0036: real time    0.0036
     EDDAV:  cpu time   21.7488: real time   21.9641
       DOS:  cpu time    0.0018: real time    0.0018
    CHARGE:  cpu time    1.1393: real time    1.1423
    MIXING:  cpu time    0.0071: real time    0.0071
    --------------------------------------------
      LOOP:  cpu time   23.0092: real time   23.2279

 eigenvalue-minimisations  : 20496
 total energy-change (2. order) :-0.1155107E-04  (-0.5144167E-07)
 number of electron      40.0000000 magnetization 
 augmentation part        1.3926515 magnetization 

 Broyden mixing:
  rms(total) = 0.23793E-04    rms(broyden)= 0.23793E-04
  rms(prec ) = 0.32352E-04
  weight for this iteration     100.00

 eigenvalues of (default mixing * dielectric matrix)
  average eigenvalue GAMMA=   2.4694
  8.0776  7.0955  4.4531  2.8575  2.4841  2.4841  1.8359  1.5862  1.2088  1.2088
  1.1535  1.1535  1.0126  1.0126  0.9651  0.9209

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        13.77443636
  Ewald energy   TEWEN  =     15846.66529757
  -Hartree energ DENC   =    -17283.82094709
  -exchange      EXHF   =         0.00000000
  -V(xc)+E(xc)   XCENC  =       150.06733755
  PAW double counting   =      3520.66553723    -3529.21454409
  entropy T*S    EENTRO =        -0.00000000
  eigenvalues    EBANDS =      -496.94457836
  atomic energy  EATOM  =      1696.75323255
  Solvation  Ediel_sol  =         0.00000000
  ---------------------------------------------------
  free energy    TOTEN  =       -82.05422827 eV

  energy without entropy =      -82.05422827  energy(sigma->0) =      -82.05422827


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




--------------------------------------- Iteration      1(  22)  ---------------------------------------


    POTLOK:  cpu time    0.1088: real time    0.1093
    SETDIJ:  cpu time    0.0027: real time    0.0027
     EDDAV:  cpu time   20.6379: real time   20.6921
       DOS:  cpu time    0.0019: real time    0.0019
    CHARGE:  cpu time    1.1732: real time    1.1760
    MIXING:  cpu time    0.0085: real time    0.0086
    --------------------------------------------
      LOOP:  cpu time   21.9330: real time   21.9906

 eigenvalue-minimisations  : 18748
 total energy-change (2. order) :-0.4028994E-05  (-0.4928031E-08)
 number of electron      40.0000000 magnetization 
 augmentation part        1.3926496 magnetization 

 Broyden mixing:
  rms(total) = 0.26910E-04    rms(broyden)= 0.26910E-04
  rms(prec ) = 0.29719E-04
  weight for this iteration     100.00

 eigenvalues of (default mixing * dielectric matrix)
  average eigenvalue GAMMA=   2.5746
  7.9764  7.9764  5.0502  3.3414  2.6459  2.6459  2.1993  1.8619  1.5062  1.1938
  1.1938  1.1683  1.1683  0.9873  0.9663  0.9663  0.9214

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        13.77443636
  Ewald energy   TEWEN  =     15846.66529757
  -Hartree energ DENC   =    -17283.83170720
  -exchange      EXHF   =         0.00000000
  -V(xc)+E(xc)   XCENC  =       150.06734890
  PAW double counting   =      3520.70848269    -3529.25747612
  entropy T*S    EENTRO =        -0.00000000
  eigenvalues    EBANDS =      -496.93384705
  atomic energy  EATOM  =      1696.75323255
  Solvation  Ediel_sol  =         0.00000000
  ---------------------------------------------------
  free energy    TOTEN  =       -82.05423230 eV

  energy without entropy =      -82.05423230  energy(sigma->0) =      -82.05423230


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




--------------------------------------- Iteration      1(  23)  ---------------------------------------


    POTLOK:  cpu time    0.1103: real time    0.1109
    SETDIJ:  cpu time    0.0016: real time    0.0016
     EDDAV:  cpu time   19.4455: real time   19.4964
       DOS:  cpu time    0.0016: real time    0.0016
    CHARGE:  cpu time    1.1388: real time    1.1418
    MIXING:  cpu time    0.0094: real time    0.0094
    --------------------------------------------
      LOOP:  cpu time   20.7072: real time   20.7617

 eigenvalue-minimisations  : 17312
 total energy-change (2. order) :-0.2542224E-05  (-0.3381822E-08)
 number of electron      40.0000000 magnetization 
 augmentation part        1.3926522 magnetization 

 Broyden mixing:
  rms(total) = 0.70789E-05    rms(broyden)= 0.70782E-05
  rms(prec ) = 0.79147E-05
  weight for this iteration     100.00

 eigenvalues of (default mixing * dielectric matrix)
  average eigenvalue GAMMA=   2.5264
  8.1991  8.1991  5.3665  3.4894  2.6958  2.5297  2.2247  1.8920  1.5203  1.1994
  1.1994  1.1584  1.1584  1.0062  0.9693  0.9693  0.8492  0.8492

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        13.77443636
  Ewald energy   TEWEN  =     15846.66529757
  -Hartree energ DENC   =    -17283.83938876
  -exchange      EXHF   =         0.00000000
  -V(xc)+E(xc)   XCENC  =       150.06737014
  PAW double counting   =      3520.69298264    -3529.24198934
  entropy T*S    EENTRO =        -0.00000000
  eigenvalues    EBANDS =      -496.92617601
  atomic energy  EATOM  =      1696.75323255
  Solvation  Ediel_sol  =         0.00000000
  ---------------------------------------------------
  free energy    TOTEN  =       -82.05423484 eV

  energy without entropy =      -82.05423484  energy(sigma->0) =      -82.05423484


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




--------------------------------------- Iteration      1(  24)  ---------------------------------------


    POTLOK:  cpu time    0.1094: real time    0.1099
    SETDIJ:  cpu time    0.0040: real time    0.0040
     EDDAV:  cpu time   22.0449: real time   22.1027
       DOS:  cpu time    0.0018: real time    0.0017
    CHARGE:  cpu time    1.1408: real time    1.1437
    MIXING:  cpu time    0.0090: real time    0.0090
    --------------------------------------------
      LOOP:  cpu time   23.3100: real time   23.3711

 eigenvalue-minimisations  : 20440
 total energy-change (2. order) :-0.2368588E-06  (-0.2706805E-09)
 number of electron      40.0000000 magnetization 
 augmentation part        1.3926514 magnetization 

 Broyden mixing:
  rms(total) = 0.73229E-05    rms(broyden)= 0.73227E-05
  rms(prec ) = 0.78618E-05
  weight for this iteration     100.00

 eigenvalues of (default mixing * dielectric matrix)
  average eigenvalue GAMMA=   2.5468
  8.7489  8.3213  5.6227  3.8293  2.7989  2.3834  2.3140  1.9332  1.5989  1.3259
  1.3259  1.1712  1.1712  1.1122  0.9613  0.9613  0.9842  0.9507  0.8745

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        13.77443636
  Ewald energy   TEWEN  =     15846.66529757
  -Hartree energ DENC   =    -17283.84004922
  -exchange      EXHF   =         0.00000000
  -V(xc)+E(xc)   XCENC  =       150.06736785
  PAW double counting   =      3520.69372629    -3529.24273640
  entropy T*S    EENTRO =        -0.00000000
  eigenvalues    EBANDS =      -496.92551009
  atomic energy  EATOM  =      1696.75323255
  Solvation  Ediel_sol  =         0.00000000
  ---------------------------------------------------
  free energy    TOTEN  =       -82.05423508 eV

  energy without entropy =      -82.05423508  energy(sigma->0) =      -82.05423508


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




--------------------------------------- Iteration      1(  25)  ---------------------------------------


    POTLOK:  cpu time    0.1105: real time    0.1110
    SETDIJ:  cpu time    0.0017: real time    0.0017
     EDDAV:  cpu time   19.5263: real time   19.5784
       DOS:  cpu time    0.0017: real time    0.0017
    CHARGE:  cpu time    1.1417: real time    1.1446
    MIXING:  cpu time    0.0098: real time    0.0098
    --------------------------------------------
      LOOP:  cpu time   20.7918: real time   20.8472

 eigenvalue-minimisations  : 17432
 total energy-change (2. order) :-0.2570341E-06  (-0.1651834E-09)
 number of electron      40.0000000 magnetization 
 augmentation part        1.3926516 magnetization 

 Broyden mixing:
  rms(total) = 0.44988E-05    rms(broyden)= 0.44988E-05
  rms(prec ) = 0.47473E-05
  weight for this iteration     100.00

 eigenvalues of (default mixing * dielectric matrix)
  average eigenvalue GAMMA=   2.5619
  9.2516  8.2731  5.7979  4.1055  2.7361  2.7361  2.5019  1.9717  1.9717  1.4527
  1.1876  1.1876  1.1813  1.1813  1.0779  0.9762  0.9762  0.9509  0.8979  0.8222

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        13.77443636
  Ewald energy   TEWEN  =     15846.66529757
  -Hartree energ DENC   =    -17283.84008898
  -exchange      EXHF   =         0.00000000
  -V(xc)+E(xc)   XCENC  =       150.06736573
  PAW double counting   =      3520.69536594    -3529.24437363
  entropy T*S    EENTRO =        -0.00000000
  eigenvalues    EBANDS =      -496.92547088
  atomic energy  EATOM  =      1696.75323255
  Solvation  Ediel_sol  =         0.00000000
  ---------------------------------------------------
  free energy    TOTEN  =       -82.05423534 eV

  energy without entropy =      -82.05423534  energy(sigma->0) =      -82.05423534


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




--------------------------------------- Iteration      1(  26)  ---------------------------------------


    POTLOK:  cpu time    0.1100: real time    0.1107
    SETDIJ:  cpu time    0.0038: real time    0.0038
     EDDAV:  cpu time   20.7354: real time   20.7934
       DOS:  cpu time    0.0017: real time    0.0017
    CHARGE:  cpu time    1.1373: real time    1.1402
    MIXING:  cpu time    0.0078: real time    0.0078
    --------------------------------------------
      LOOP:  cpu time   21.9959: real time   22.0575

 eigenvalue-minimisations  : 18780
 total energy-change (2. order) :-0.1057010E-06  (-0.1210073E-09)
 number of electron      40.0000000 magnetization 
 augmentation part        1.3926511 magnetization 

 Broyden mixing:
  rms(total) = 0.16109E-05    rms(broyden)= 0.16108E-05
  rms(prec ) = 0.16652E-05
  weight for this iteration     100.00

 eigenvalues of (default mixing * dielectric matrix)
  average eigenvalue GAMMA=   2.5169
  9.3150  8.2699  5.8164  4.1187  2.9408  2.5501  2.3847  2.1915  1.8406  1.4525
  1.4525  1.1944  1.1944  1.1782  1.1782  1.1276  1.0529  0.9496  0.9496  0.9318
  0.7656

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        13.77443636
  Ewald energy   TEWEN  =     15846.66529757
  -Hartree energ DENC   =    -17283.83985018
  -exchange      EXHF   =         0.00000000
  -V(xc)+E(xc)   XCENC  =       150.06736353
  PAW double counting   =      3520.69230787    -3529.24131416
  entropy T*S    EENTRO =        -0.00000000
  eigenvalues    EBANDS =      -496.92570899
  atomic energy  EATOM  =      1696.75323255
  Solvation  Ediel_sol  =         0.00000000
  ---------------------------------------------------
  free energy    TOTEN  =       -82.05423544 eV

  energy without entropy =      -82.05423544  energy(sigma->0) =      -82.05423544


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




--------------------------------------- Iteration      1(  27)  ---------------------------------------


    POTLOK:  cpu time    0.1104: real time    0.1110
    SETDIJ:  cpu time    0.0025: real time    0.0025
     EDDAV:  cpu time   21.9166: real time   21.9922
       DOS:  cpu time    0.0018: real time    0.0018
    CHARGE:  cpu time    1.1369: real time    1.1398
    MIXING:  cpu time    0.0097: real time    0.0097
    --------------------------------------------
      LOOP:  cpu time   23.1778: real time   23.2569

 eigenvalue-minimisations  : 20592
 total energy-change (2. order) :-0.1525677E-07  (-0.1149507E-10)
 number of electron      40.0000000 magnetization 
 augmentation part        1.3926513 magnetization 

 Broyden mixing:
  rms(total) = 0.59106E-06    rms(broyden)= 0.59101E-06
  rms(prec ) = 0.63400E-06
  weight for this iteration     100.00

 eigenvalues of (default mixing * dielectric matrix)
  average eigenvalue GAMMA=   2.5032
  9.3977  8.2750  5.8880  4.2967  3.0907  2.7475  2.3904  2.3904  1.8223  1.8223
  1.3474  1.3474  1.1788  1.1788  1.1215  1.1215  1.1252  0.9502  0.9502  0.9329
  0.9329  0.7623

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        13.77443636
  Ewald energy   TEWEN  =     15846.66529757
  -Hartree energ DENC   =    -17283.83992130
  -exchange      EXHF   =         0.00000000
  -V(xc)+E(xc)   XCENC  =       150.06736255
  PAW double counting   =      3520.69255063    -3529.24155764
  entropy T*S    EENTRO =        -0.00000000
  eigenvalues    EBANDS =      -496.92563619
  atomic energy  EATOM  =      1696.75323255
  Solvation  Ediel_sol  =         0.00000000
  ---------------------------------------------------
  free energy    TOTEN  =       -82.05423546 eV

  energy without entropy =      -82.05423546  energy(sigma->0) =      -82.05423546


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




--------------------------------------- Iteration      1(  28)  ---------------------------------------


    POTLOK:  cpu time    0.1130: real time    0.1135
    SETDIJ:  cpu time    0.0011: real time    0.0011
     EDDAV:  cpu time   19.5254: real time   19.5947
       DOS:  cpu time    0.0017: real time    0.0017
    CHARGE:  cpu time    1.1360: real time    1.1388
    MIXING:  cpu time    0.0105: real time    0.0105
    --------------------------------------------
      LOOP:  cpu time   20.7877: real time   20.8604

 eigenvalue-minimisations  : 17404
 total energy-change (2. order) :-0.1026092E-07  (-0.6518338E-11)
 number of electron      40.0000000 magnetization 
 augmentation part        1.3926513 magnetization 

 Broyden mixing:
  rms(total) = 0.32530E-06    rms(broyden)= 0.32530E-06
  rms(prec ) = 0.34238E-06
  weight for this iteration     100.00

 eigenvalues of (default mixing * dielectric matrix)
  average eigenvalue GAMMA=   2.4638
  9.3853  8.3013  5.8884  4.3737  3.2311  2.6819  2.4860  2.2570  1.9358  1.9358
  1.4760  1.1805  1.1805  1.1900  1.1900  1.1816  1.1816  1.0019  1.0019  0.9259
  0.9605  0.9605  0.7597

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        13.77443636
  Ewald energy   TEWEN  =     15846.66529757
  -Hartree energ DENC   =    -17283.83983410
  -exchange      EXHF   =         0.00000000
  -V(xc)+E(xc)   XCENC  =       150.06736117
  PAW double counting   =      3520.69273158    -3529.24173857
  entropy T*S    EENTRO =        -0.00000000
  eigenvalues    EBANDS =      -496.92572204
  atomic energy  EATOM  =      1696.75323255
  Solvation  Ediel_sol  =         0.00000000
  ---------------------------------------------------
  free energy    TOTEN  =       -82.05423547 eV

  energy without entropy =      -82.05423547  energy(sigma->0) =      -82.05423547


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




--------------------------------------- Iteration      1(  29)  ---------------------------------------


    POTLOK:  cpu time    0.1124: real time    0.1128
    SETDIJ:  cpu time    0.0030: real time    0.0030
     EDDAV:  cpu time   20.9515: real time   21.1637
       DOS:  cpu time    0.0017: real time    0.0017
    --------------------------------------------
      LOOP:  cpu time   21.0685: real time   21.2812

 eigenvalue-minimisations  : 19264
 total energy-change (2. order) :-0.1842636E-08  (-0.7486653E-12)
 number of electron      40.0000000 magnetization 
 augmentation part        1.3926513 magnetization 

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        13.77443636
  Ewald energy   TEWEN  =     15846.66529757
  -Hartree energ DENC   =    -17283.83984953
  -exchange      EXHF   =         0.00000000
  -V(xc)+E(xc)   XCENC  =       150.06736175
  PAW double counting   =      3520.69277774    -3529.24178486
  entropy T*S    EENTRO =        -0.00000000
  eigenvalues    EBANDS =      -496.92570706
  atomic energy  EATOM  =      1696.75323255
  Solvation  Ediel_sol  =         0.00000000
  ---------------------------------------------------
  free energy    TOTEN  =       -82.05423547 eV

  energy without entropy =      -82.05423547  energy(sigma->0) =      -82.05423547


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




 average (electrostatic) potential at core
  the test charge radii are     0.6991  0.5201  0.7089
  (the norm of the test charge is              1.0000)
       1 -59.7779       2 -59.7785       3 -59.7783       4 -59.7788       5 -40.6243
       6 -40.6203       7 -40.6212       8 -40.6226       9 -72.5511      10 -72.5513
      11 -72.5512      12 -72.5513
 
 
 
 E-fermi :  -3.1052     XC(G=0):  -1.9597     alpha+bet : -1.6608


 k-point     1 :       0.0000    0.0000    0.0000
  band No.  band energies     occupation 
      1     -25.7165      2.00000
      2     -21.3816      2.00000
      3     -20.6296      2.00000
      4     -20.4253      2.00000
      5     -17.2649      2.00000
      6     -15.5161      2.00000
      7     -14.8875      2.00000
      8     -13.4850      2.00000
      9     -12.6372      2.00000
     10     -12.2239      2.00000
     11     -11.0312      2.00000
     12     -11.0289      2.00000
     13      -9.9204      2.00000
     14      -9.3140      2.00000
     15      -8.4783      2.00000
     16      -7.6971      2.00000
     17      -5.1007      2.00000
     18      -4.0455      2.00000
     19      -3.7239      2.00000
     20      -3.1672      2.00000
     21       0.4817      0.00000
     22       0.5559      0.00000
     23       1.3730      0.00000
     24       1.5921      0.00000
     25       1.9582      0.00000
     26       2.3836      0.00000
     27       2.4707      0.00000
     28       2.6970      0.00000

 k-point     2 :       0.0625    0.0000    0.0000
  band No.  band energies     occupation 
      1     -25.6896      2.00000
      2     -21.3618      2.00000
      3     -20.6163      2.00000
      4     -20.5933      2.00000
      5     -17.0678      2.00000
      6     -15.6314      2.00000
      7     -15.0145      2.00000
      8     -13.4199      2.00000
      9     -12.6149      2.00000
     10     -12.0874      2.00000
     11     -11.0068      2.00000
     12     -10.9290      2.00000
     13      -9.9380      2.00000
     14      -9.3619      2.00000
     15      -8.5301      2.00000
     16      -7.7372      2.00000
     17      -5.0864      2.00000
     18      -4.0701      2.00000
     19      -3.7708      2.00000
     20      -3.1910      2.00000
     21       0.5043      0.00000
     22       0.5858      0.00000
     23       1.4093      0.00000
     24       1.6269      0.00000
     25       1.9924      0.00000
     26       2.4148      0.00000
     27       2.5520      0.00000
     28       2.7843      0.00000

 k-point     3 :       0.1250    0.0000    0.0000
  band No.  band energies     occupation 
      1     -25.6093      2.00000
      2     -21.3032      2.00000
      3     -21.0054      2.00000
      4     -20.5781      2.00000
      5     -16.5701      2.00000
      6     -15.9230      2.00000
      7     -15.3267      2.00000
      8     -13.2681      2.00000
      9     -12.5490      2.00000
     10     -11.7366      2.00000
     11     -10.9415      2.00000
     12     -10.6512      2.00000
     13      -9.9955      2.00000
     14      -9.4976      2.00000
     15      -8.6768      2.00000
     16      -7.8473      2.00000
     17      -5.0417      2.00000
     18      -4.1516      2.00000
     19      -3.9042      2.00000
     20      -3.2612      2.00000
     21       0.5744      0.00000
     22       0.6767      0.00000
     23       1.5183      0.00000
     24       1.7320      0.00000
     25       2.0953      0.00000
     26       2.5097      0.00000
     27       2.7845      0.00000
     28       2.9717      0.00000

 k-point     4 :       0.1875    0.0000    0.0000
  band No.  band energies     occupation 
      1     -25.4756      2.00000
      2     -21.5239      2.00000
      3     -21.2081      2.00000
      4     -20.5207      2.00000
      5     -16.2925      2.00000
      6     -15.9147      2.00000
      7     -15.7213      2.00000
      8     -13.0773      2.00000
      9     -12.4432      2.00000
     10     -11.2881      2.00000
     11     -10.8388      2.00000
     12     -10.2642      2.00000
     13     -10.1054      2.00000
     14      -9.6917      2.00000
     15      -8.8939      2.00000
     16      -8.0038      2.00000
     17      -4.9635      2.00000
     18      -4.3021      2.00000
     19      -4.1043      2.00000
     20      -3.3735      2.00000
     21       0.6981      0.00000
     22       0.8318      0.00000
     23       1.7002      0.00000
     24       1.9083      0.00000
     25       2.2681      0.00000
     26       2.6700      0.00000
     27       3.0691      0.00000
     28       3.1348      0.00000

 k-point     5 :       0.2500    0.0000    0.0000
  band No.  band energies     occupation 
      1     -25.2890      2.00000
      2     -22.0707      2.00000
      3     -21.0810      2.00000
      4     -20.4545      2.00000
      5     -16.6641      2.00000
      6     -16.1337      2.00000
      7     -15.1889      2.00000
      8     -12.8578      2.00000
      9     -12.3057      2.00000
     10     -10.8866      2.00000
     11     -10.7133      2.00000
     12     -10.2806      2.00000
     13      -9.8606      2.00000
     14      -9.8412      2.00000
     15      -9.1422      2.00000
     16      -8.1835      2.00000
     17      -4.8510      2.00000
     18      -4.5159      2.00000
     19      -4.3440      2.00000
     20      -3.5195      2.00000
     21       0.8819      0.00000
     22       1.0551      0.00000
     23       1.9552      0.00000
     24       2.1564      0.00000
     25       2.5121      0.00000
     26       2.8923      0.00000
     27       3.2332      0.00000
     28       3.4439      0.00000

 k-point     6 :       0.3125    0.0000    0.0000
  band No.  band energies     occupation 
      1     -25.0502      2.00000
      2     -22.6092      2.00000
      3     -20.9295      2.00000
      4     -20.3963      2.00000
      5     -16.9852      2.00000
      6     -16.5248      2.00000
      7     -14.4432      2.00000
      8     -12.6077      2.00000
      9     -12.1560      2.00000
     10     -10.7880      2.00000
     11     -10.6029      2.00000
     12     -10.5198      2.00000
     13      -9.7850      2.00000
     14      -9.4497      2.00000
     15      -9.3588      2.00000
     16      -8.3785      2.00000
     17      -4.7567      2.00000
     18      -4.7088      2.00000
     19      -4.5938      2.00000
     20      -3.6866      2.00000
     21       1.1293      0.00000
     22       1.3489      0.00000
     23       2.2835      0.00000
     24       2.4758      0.00000
     25       2.8289      0.00000
     26       3.1373      0.00000
     27       3.3988      0.00000
     28       3.4433      0.00000

 k-point     7 :       0.3750    0.0000    0.0000
  band No.  band energies     occupation 
      1     -24.7601      2.00000
      2     -23.1214      2.00000
      3     -20.7653      2.00000
      4     -20.3678      2.00000
      5     -17.2144      2.00000
      6     -16.8658      2.00000
      7     -13.7154      2.00000
      8     -12.3260      2.00000
      9     -12.0481      2.00000
     10     -11.0129      2.00000
     11     -10.7794      2.00000
     12     -10.5852      2.00000
     13      -9.4730      2.00000
     14      -9.4452      2.00000
     15      -9.1498      2.00000
     16      -8.5976      2.00000
     17      -4.9656      2.00000
     18      -4.8231      2.00000
     19      -4.5463      2.00000
     20      -3.8614      2.00000
     21       1.4383      0.00000
     22       1.7124      0.00000
     23       2.6851      0.00000
     24       2.8583      0.00000
     25       3.0303      0.00000
     26       3.2183      0.00000
     27       3.2216      0.00000
     28       3.6973      0.00000

 k-point     8 :       0.4375    0.0000    0.0000
  band No.  band energies     occupation 
      1     -24.4200      2.00000
      2     -23.5975      2.00000
      3     -20.6057      2.00000
      4     -20.3906      2.00000
      5     -17.3204      2.00000
      6     -17.1297      2.00000
      7     -13.0434      2.00000
      8     -12.1184      2.00000
      9     -12.0151      2.00000
     10     -11.3384      2.00000
     11     -10.9294      2.00000
     12     -10.7030      2.00000
     13      -9.3411      2.00000
     14      -9.1754      2.00000
     15      -8.9909      2.00000
     16      -8.8481      2.00000
     17      -5.0881      2.00000
     18      -5.0013      2.00000
     19      -4.3755      2.00000
     20      -4.0346      2.00000
     21       1.7987      0.00000
     22       2.1419      0.00000
     23       2.5976      0.00000
     24       3.0970      0.00000
     25       3.1598      0.00000
     26       3.1719      0.00000
     27       3.3818      0.00000
     28       3.4016      0.00000

 k-point     9 :       0.5000    0.0000    0.0000
  band No.  band energies     occupation 
      1     -24.0320      2.00000
      2     -24.0311      2.00000
      3     -20.4741      2.00000
      4     -20.4726      2.00000
      5     -17.2908      2.00000
      6     -17.2877      2.00000
      7     -12.4807      2.00000
      8     -12.4779      2.00000
      9     -11.6824      2.00000
     10     -11.6809      2.00000
     11     -10.8676      2.00000
     12     -10.8664      2.00000
     13      -9.1139      2.00000
     14      -9.1123      2.00000
     15      -9.0015      2.00000
     16      -9.0002      2.00000
     17      -5.1002      2.00000
     18      -5.0955      2.00000
     19      -4.2062      2.00000
     20      -4.2034      2.00000
     21       2.1903      0.00000
     22       2.1907      0.00000
     23       2.6306      0.00000
     24       2.6323      0.00000
     25       3.1519      0.00000
     26       3.1522      0.00000
     27       3.7070      0.00000
     28       3.7071      0.00000

 k-point    10 :       0.0000    0.0667    0.0000
  band No.  band energies     occupation 
      1     -25.6920      2.00000
      2     -21.6180      2.00000
      3     -20.4166      2.00000
      4     -20.4059      2.00000
      5     -17.2540      2.00000
      6     -15.7482      2.00000
      7     -14.6390      2.00000
      8     -13.4492      2.00000
      9     -12.7151      2.00000
     10     -12.3273      2.00000
     11     -11.0079      2.00000
     12     -10.8993      2.00000
     13      -9.9042      2.00000
     14      -9.2901      2.00000
     15      -8.5400      2.00000
     16      -7.6818      2.00000
     17      -5.1238      2.00000
     18      -4.0548      2.00000
     19      -3.7400      2.00000
     20      -3.1895      2.00000
     21       0.5026      0.00000
     22       0.5758      0.00000
     23       1.4079      0.00000
     24       1.6263      0.00000
     25       1.9845      0.00000
     26       2.4166      0.00000
     27       2.4983      0.00000
     28       2.6144      0.00000

 k-point    11 :       0.0625    0.0667    0.0000
  band No.  band energies     occupation 
      1     -25.6652      2.00000
      2     -21.5971      2.00000
      3     -20.5737      2.00000
      4     -20.4062      2.00000
      5     -17.0580      2.00000
      6     -15.8601      2.00000
      7     -14.7666      2.00000
      8     -13.3812      2.00000
      9     -12.6911      2.00000
     10     -12.1952      2.00000
     11     -10.9895      2.00000
     12     -10.7970      2.00000
     13      -9.9218      2.00000
     14      -9.3371      2.00000
     15      -8.5885      2.00000
     16      -7.7205      2.00000
     17      -5.1106      2.00000
     18      -4.0792      2.00000
     19      -3.7864      2.00000
     20      -3.2139      2.00000
     21       0.5254      0.00000
     22       0.6055      0.00000
     23       1.4442      0.00000
     24       1.6612      0.00000
     25       2.0184      0.00000
     26       2.4476      0.00000
     27       2.5721      0.00000
     28       2.6868      0.00000

 k-point    12 :       0.1250    0.0667    0.0000
  band No.  band energies     occupation 
      1     -25.5848      2.00000
      2     -21.5351      2.00000
      3     -20.9850      2.00000
      4     -20.3777      2.00000
      5     -16.5635      2.00000
      6     -16.1402      2.00000
      7     -15.0817      2.00000
      8     -13.2242      2.00000
      9     -12.6199      2.00000
     10     -11.8509      2.00000
     11     -10.9377      2.00000
     12     -10.5222      2.00000
     13      -9.9777      2.00000
     14      -9.4703      2.00000
     15      -8.7234      2.00000
     16      -7.8291      2.00000
     17      -5.0691      2.00000
     18      -4.1599      2.00000
     19      -3.9181      2.00000
     20      -3.2858      2.00000
     21       0.5960      0.00000
     22       0.6957      0.00000
     23       1.5531      0.00000
     24       1.7664      0.00000
     25       2.1204      0.00000
     26       2.5425      0.00000
     27       2.7783      0.00000
     28       2.8673      0.00000

 k-point    13 :       0.1875    0.0667    0.0000
  band No.  band energies     occupation 
      1     -25.4512      2.00000
      2     -21.5028      2.00000
      3     -21.4338      2.00000
      4     -20.3385      2.00000
      5     -16.4886      2.00000
      6     -15.9133      2.00000
      7     -15.4829      2.00000
      8     -13.0295      2.00000
      9     -12.5048      2.00000
     10     -11.3988      2.00000
     11     -10.8662      2.00000
     12     -10.1499      2.00000
     13     -10.0752      2.00000
     14      -9.6596      2.00000
     15      -8.9189      2.00000
     16      -7.9877      2.00000
     17      -4.9950      2.00000
     18      -4.3088      2.00000
     19      -4.1159      2.00000
     20      -3.4005      2.00000
     21       0.7205      0.00000
     22       0.8493      0.00000
     23       1.7348      0.00000
     24       1.9428      0.00000
     25       2.2916      0.00000
     26       2.7031      0.00000
     27       3.0615      0.00000
     28       3.0674      0.00000

 k-point    14 :       0.2500    0.0667    0.0000
  band No.  band energies     occupation 
      1     -25.2647      2.00000
      2     -22.0490      2.00000
      3     -21.2967      2.00000
      4     -20.3024      2.00000
      5     -16.8270      2.00000
      6     -15.9065      2.00000
      7     -15.1956      2.00000
      8     -12.8082      2.00000
      9     -12.3537      2.00000
     10     -10.9664      2.00000
     11     -10.8150      2.00000
     12     -10.1962      2.00000
     13      -9.9002      2.00000
     14      -9.6915      2.00000
     15      -9.1422      2.00000
     16      -8.1732      2.00000
     17      -4.8869      2.00000
     18      -4.5202      2.00000
     19      -4.3534      2.00000
     20      -3.5491      2.00000
     21       0.9053      0.00000
     22       1.0705      0.00000
     23       1.9896      0.00000
     24       2.1911      0.00000
     25       2.5337      0.00000
     26       2.9240      0.00000
     27       3.2379      0.00000
     28       3.3432      0.00000

 k-point    15 :       0.3125    0.0667    0.0000
  band No.  band energies     occupation 
      1     -25.0261      2.00000
      2     -22.5869      2.00000
      3     -21.1296      2.00000
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     10     -10.8643      2.00000
     11     -10.7956      2.00000
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     13      -9.8508      2.00000
     14      -9.3512      2.00000
     15      -9.3439      2.00000
     16      -8.3736      2.00000
     17      -4.7586      2.00000
     18      -4.7484      2.00000
     19      -4.6014      2.00000
     20      -3.7190      2.00000
     21       1.1536      0.00000
     22       1.3618      0.00000
     23       2.3177      0.00000
     24       2.5103      0.00000
     25       2.8481      0.00000
     26       3.1330      0.00000
     27       3.3554      0.00000
     28       3.6024      0.00000

 k-point    16 :       0.3750    0.0667    0.0000
  band No.  band energies     occupation 
      1     -24.7361      2.00000
      2     -23.0986      2.00000
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     12     -10.3791      2.00000
     13      -9.5447      2.00000
     14      -9.4268      2.00000
     15      -9.0864      2.00000
     16      -8.5937      2.00000
     17      -4.9663      2.00000
     18      -4.8291      2.00000
     19      -4.5886      2.00000
     20      -3.8966      2.00000
     21       1.4632      0.00000
     22       1.7226      0.00000
     23       2.7190      0.00000
     24       2.8821      0.00000
     25       2.9893      0.00000
     26       3.2344      0.00000
     27       3.3088      0.00000
     28       3.7208      0.00000

 k-point    17 :       0.4375    0.0667    0.0000
  band No.  band energies     occupation 
      1     -24.3962      2.00000
      2     -23.5743      2.00000
      3     -20.7457      2.00000
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     10     -11.2986      2.00000
     11     -11.0187      2.00000
     12     -10.5819      2.00000
     13      -9.3221      2.00000
     14      -9.2233      2.00000
     15      -8.9655      2.00000
     16      -8.8402      2.00000
     17      -5.0891      2.00000
     18      -5.0055      2.00000
     19      -4.4186      2.00000
     20      -4.0730      2.00000
     21       1.8235      0.00000
     22       2.1490      0.00000
     23       2.6050      0.00000
     24       3.1250      0.00000
     25       3.1686      0.00000
     26       3.1935      0.00000
     27       3.4004      0.00000
     28       3.4481      0.00000

 k-point    18 :       0.5000    0.0667    0.0000
  band No.  band energies     occupation 
      1     -24.0086      2.00000
      2     -24.0076      2.00000
      3     -20.5628      2.00000
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      5     -17.2001      2.00000
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     10     -11.6362      2.00000
     11     -10.8374      2.00000
     12     -10.8362      2.00000
     13      -9.0995      2.00000
     14      -9.0980      2.00000
     15      -9.0148      2.00000
     16      -9.0134      2.00000
     17      -5.1026      2.00000
     18      -5.0979      2.00000
     19      -4.2476      2.00000
     20      -4.2448      2.00000
     21       2.2127      0.00000
     22       2.2131      0.00000
     23       2.6337      0.00000
     24       2.6354      0.00000
     25       3.1742      0.00000
     26       3.1747      0.00000
     27       3.7398      0.00000
     28       3.7399      0.00000

 k-point    19 :      -0.4375    0.0667    0.0000
  band No.  band energies     occupation 
      1     -24.3962      2.00000
      2     -23.5743      2.00000
      3     -20.7456      2.00000
      4     -20.4142      2.00000
      5     -17.2976      2.00000
      6     -16.9854      2.00000
      7     -13.0994      2.00000
      8     -12.1748      2.00000
      9     -11.9675      2.00000
     10     -11.2987      2.00000
     11     -11.0183      2.00000
     12     -10.5818      2.00000
     13      -9.3219      2.00000
     14      -9.2224      2.00000
     15      -8.9664      2.00000
     16      -8.8405      2.00000
     17      -5.0892      2.00000
     18      -5.0053      2.00000
     19      -4.4190      2.00000
     20      -4.0726      2.00000
     21       1.8234      0.00000
     22       2.1490      0.00000
     23       2.6049      0.00000
     24       3.1253      0.00000
     25       3.1687      0.00000
     26       3.1935      0.00000
     27       3.4003      0.00000
     28       3.4480      0.00000

 k-point    20 :      -0.3750    0.0667    0.0000
  band No.  band energies     occupation 
      1     -24.7361      2.00000
      2     -23.0986      2.00000
      3     -20.9413      2.00000
      4     -20.3219      2.00000
      5     -17.2642      2.00000
      6     -16.6829      2.00000
      7     -13.7508      2.00000
      8     -12.2767      2.00000
      9     -12.0758      2.00000
     10     -11.0001      2.00000
     11     -10.9843      2.00000
     12     -10.3786      2.00000
     13      -9.5437      2.00000
     14      -9.4268      2.00000
     15      -9.0873      2.00000
     16      -8.5940      2.00000
     17      -4.9665      2.00000
     18      -4.8289      2.00000
     19      -4.5891      2.00000
     20      -3.8962      2.00000
     21       1.4631      0.00000
     22       1.7226      0.00000
     23       2.7190      0.00000
     24       2.8819      0.00000
     25       2.9889      0.00000
     26       3.2343      0.00000
     27       3.3093      0.00000
     28       3.7204      0.00000

 k-point    21 :      -0.3125    0.0667    0.0000
  band No.  band energies     occupation 
      1     -25.0261      2.00000
      2     -22.5869      2.00000
      3     -21.1296      2.00000
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      5     -17.0991      2.00000
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      8     -12.5577      2.00000
      9     -12.1883      2.00000
     10     -10.8647      2.00000
     11     -10.7957      2.00000
     12     -10.2845      2.00000
     13      -9.8497      2.00000
     14      -9.3521      2.00000
     15      -9.3439      2.00000
     16      -8.3739      2.00000
     17      -4.7589      2.00000
     18      -4.7488      2.00000
     19      -4.6011      2.00000
     20      -3.7186      2.00000
     21       1.1535      0.00000
     22       1.3618      0.00000
     23       2.3177      0.00000
     24       2.5103      0.00000
     25       2.8481      0.00000
     26       3.1325      0.00000
     27       3.3550      0.00000
     28       3.6175      0.00000

 k-point    22 :      -0.2500    0.0667    0.0000
  band No.  band energies     occupation 
      1     -25.2648      2.00000
      2     -22.0490      2.00000
      3     -21.2967      2.00000
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     10     -10.9661      2.00000
     11     -10.8155      2.00000
     12     -10.1953      2.00000
     13      -9.8995      2.00000
     14      -9.6923      2.00000
     15      -9.1422      2.00000
     16      -8.1735      2.00000
     17      -4.8873      2.00000
     18      -4.5204      2.00000
     19      -4.3532      2.00000
     20      -3.5488      2.00000
     21       0.9053      0.00000
     22       1.0705      0.00000
     23       1.9896      0.00000
     24       2.1910      0.00000
     25       2.5337      0.00000
     26       2.9238      0.00000
     27       3.2376      0.00000
     28       3.3432      0.00000

 k-point    23 :      -0.1875    0.0667    0.0000
  band No.  band energies     occupation 
      1     -25.4512      2.00000
      2     -21.5028      2.00000
      3     -21.4338      2.00000
      4     -20.3386      2.00000
      5     -16.4882      2.00000
      6     -15.9133      2.00000
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      8     -13.0294      2.00000
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     10     -11.3982      2.00000
     11     -10.8665      2.00000
     12     -10.1505      2.00000
     13     -10.0747      2.00000
     14      -9.6594      2.00000
     15      -8.9188      2.00000
     16      -7.9879      2.00000
     17      -4.9954      2.00000
     18      -4.3090      2.00000
     19      -4.1157      2.00000
     20      -3.4002      2.00000
     21       0.7205      0.00000
     22       0.8493      0.00000
     23       1.7348      0.00000
     24       1.9428      0.00000
     25       2.2916      0.00000
     26       2.7030      0.00000
     27       3.0617      0.00000
     28       3.0674      0.00000

 k-point    24 :      -0.1250    0.0667    0.0000
  band No.  band energies     occupation 
      1     -25.5848      2.00000
      2     -21.5351      2.00000
      3     -20.9850      2.00000
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      5     -16.5635      2.00000
      6     -16.1398      2.00000
      7     -15.0824      2.00000
      8     -13.2241      2.00000
      9     -12.6200      2.00000
     10     -11.8503      2.00000
     11     -10.9379      2.00000
     12     -10.5227      2.00000
     13      -9.9774      2.00000
     14      -9.4701      2.00000
     15      -8.7233      2.00000
     16      -7.8293      2.00000
     17      -5.0693      2.00000
     18      -4.1601      2.00000
     19      -3.9179      2.00000
     20      -3.2856      2.00000
     21       0.5959      0.00000
     22       0.6957      0.00000
     23       1.5531      0.00000
     24       1.7664      0.00000
     25       2.1204      0.00000
     26       2.5425      0.00000
     27       2.7784      0.00000
     28       2.8676      0.00000

 k-point    25 :      -0.0625    0.0667    0.0000
  band No.  band energies     occupation 
      1     -25.6652      2.00000
      2     -21.5971      2.00000
      3     -20.5737      2.00000
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      5     -17.0580      2.00000
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     10     -12.1948      2.00000
     11     -10.9896      2.00000
     12     -10.7973      2.00000
     13      -9.9217      2.00000
     14      -9.3370      2.00000
     15      -8.5884      2.00000
     16      -7.7206      2.00000
     17      -5.1108      2.00000
     18      -4.0793      2.00000
     19      -3.7863      2.00000
     20      -3.2139      2.00000
     21       0.5253      0.00000
     22       0.6055      0.00000
     23       1.4442      0.00000
     24       1.6612      0.00000
     25       2.0184      0.00000
     26       2.4476      0.00000
     27       2.5722      0.00000
     28       2.6870      0.00000

 k-point    26 :       0.0000    0.1333    0.0000
  band No.  band energies     occupation 
      1     -25.6188      2.00000
      2     -22.0477      2.00000
      3     -20.3485      2.00000
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      8     -13.3736      2.00000
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     10     -12.5110      2.00000
     11     -10.9668      2.00000
     12     -10.6035      2.00000
     13      -9.8687      2.00000
     14      -9.2195      2.00000
     15      -8.7043      2.00000
     16      -7.6507      2.00000
     17      -5.1838      2.00000
     18      -4.0829      2.00000
     19      -3.7932      2.00000
     20      -3.2562      2.00000
     21       0.5674      0.00000
     22       0.6357      0.00000
     23       1.5124      0.00000
     24       1.7292      0.00000
     25       2.0610      0.00000
     26       2.5154      0.00000
     27       2.5756      0.00000
     28       2.5820      0.00000

 k-point    27 :       0.0625    0.1333    0.0000
  band No.  band energies     occupation 
      1     -25.5920      2.00000
      2     -22.0253      2.00000
      3     -20.5151      2.00000
      4     -20.0577      2.00000
      5     -17.0302      2.00000
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      8     -13.2928      2.00000
      9     -12.8902      2.00000
     10     -12.3935      2.00000
     11     -10.9595      2.00000
     12     -10.5042      2.00000
     13      -9.8860      2.00000
     14      -9.2634      2.00000
     15      -8.7425      2.00000
     16      -7.6856      2.00000
     17      -5.1740      2.00000
     18      -4.1067      2.00000
     19      -3.8382      2.00000
     20      -3.2822      2.00000
     21       0.5906      0.00000
     22       0.6647      0.00000
     23       1.5486      0.00000
     24       1.7643      0.00000
     25       2.0938      0.00000
     26       2.5452      0.00000
     27       2.6302      0.00000
     28       2.6564      0.00000

 k-point    28 :       0.1250    0.1333    0.0000
  band No.  band energies     occupation 
      1     -25.5118      2.00000
      2     -21.9587      2.00000
      3     -20.9244      2.00000
      4     -20.0549      2.00000
      5     -16.5456      2.00000
      6     -16.4717      2.00000
      7     -14.6597      2.00000
      8     -13.1105      2.00000
      9     -12.8055      2.00000
     10     -12.0752      2.00000
     11     -10.9460      2.00000
     12     -10.2426      2.00000
     13      -9.9356      2.00000
     14      -9.3877      2.00000
     15      -8.8444      2.00000
     16      -7.7884      2.00000
     17      -5.1417      2.00000
     18      -4.1852      2.00000
     19      -3.9658      2.00000
     20      -3.3585      2.00000
     21       0.6628      0.00000
     22       0.7526      0.00000
     23       1.6572      0.00000
     24       1.8698      0.00000
     25       2.1924      0.00000
     26       2.6405      0.00000
     27       2.7790      0.00000
     28       2.8493      0.00000

 k-point    29 :       0.1875    0.1333    0.0000
  band No.  band energies     occupation 
      1     -25.3783      2.00000
      2     -21.8490      2.00000
      3     -21.4399      2.00000
      4     -20.0636      2.00000
      5     -16.7679      2.00000
      6     -15.9121      2.00000
      7     -15.0664      2.00000
      8     -12.8965      2.00000
      9     -12.6660      2.00000
     10     -11.6297      2.00000
     11     -10.9546      2.00000
     12     -10.0012      2.00000
     13      -9.9106      2.00000
     14      -9.5567      2.00000
     15      -8.9839      2.00000
     16      -7.9487      2.00000
     17      -5.0801      2.00000
     18      -4.3294      2.00000
     19      -4.1574      2.00000
     20      -3.4795      2.00000
     21       0.7898      0.00000
     22       0.9017      0.00000
     23       1.8385      0.00000
     24       2.0466      0.00000
     25       2.3580      0.00000
     26       2.8016      0.00000
     27       2.9862      0.00000
     28       3.0815      0.00000

 k-point    30 :       0.2500    0.1333    0.0000
  band No.  band energies     occupation 
      1     -25.1922      2.00000
      2     -21.9840      2.00000
      3     -21.6985      2.00000
      4     -20.1030      2.00000
      5     -17.0272      2.00000
      6     -15.5011      2.00000
      7     -15.2196      2.00000
      8     -12.6656      2.00000
      9     -12.4783      2.00000
     10     -11.1559      2.00000
     11     -11.0313      2.00000
     12     -10.0426      2.00000
     13      -9.8451      2.00000
     14      -9.4656      2.00000
     15      -9.1443      2.00000
     16      -8.1468      2.00000
     17      -4.9852      2.00000
     18      -4.5344      2.00000
     19      -4.3885      2.00000
     20      -3.6351      2.00000
     21       0.9773      0.00000
     22       1.1165      0.00000
     23       2.0926      0.00000
     24       2.2951      0.00000
     25       2.5928      0.00000
     26       3.0142      0.00000
     27       3.2324      0.00000
     28       3.2458      0.00000

 k-point    31 :       0.3125    0.1333    0.0000
  band No.  band energies     occupation 
      1     -24.9539      2.00000
      2     -22.5202      2.00000
      3     -21.5109      2.00000
      4     -20.1943      2.00000
      5     -17.1928      2.00000
      6     -15.9286      2.00000
      7     -14.5223      2.00000
      8     -12.4122      2.00000
      9     -12.2701      2.00000
     10     -11.1842      2.00000
     11     -10.8395      2.00000
     12     -10.0490      2.00000
     13      -9.9107      2.00000
     14      -9.3057      2.00000
     15      -9.1725      2.00000
     16      -8.3615      2.00000
     17      -4.8587      2.00000
     18      -4.7667      2.00000
     19      -4.6310      2.00000
     20      -3.8121      2.00000
     21       1.2280      0.00000
     22       1.4002      0.00000
     23       2.4199      0.00000
     24       2.6136      0.00000
     25       2.8987      0.00000
     26       3.0988      0.00000
     27       3.4035      0.00000
     28       3.5247      0.00000

 k-point    32 :       0.3750    0.1333    0.0000
  band No.  band energies     occupation 
      1     -24.6645      2.00000
      2     -23.0305      2.00000
      3     -21.2919      2.00000
      4     -20.3484      2.00000
      5     -17.2345      2.00000
      6     -16.3257      2.00000
      7     -13.8594      2.00000
      8     -12.1597      2.00000
      9     -12.1325      2.00000
     10     -11.2811      2.00000
     11     -10.9077      2.00000
     12     -10.1307      2.00000
     13      -9.6717      2.00000
     14      -9.3766      2.00000
     15      -8.9756      2.00000
     16      -8.5850      2.00000
     17      -4.9718      2.00000
     18      -4.8535      2.00000
     19      -4.7076      2.00000
     20      -3.9973      2.00000
     21       1.5390      0.00000
     22       1.7527      0.00000
     23       2.8202      0.00000
     24       2.8837      0.00000
     25       3.0275      0.00000
     26       3.2734      0.00000
     27       3.4690      0.00000
     28       3.6705      0.00000

 k-point    33 :       0.4375    0.1333    0.0000
  band No.  band energies     occupation 
      1     -24.3252      2.00000
      2     -23.5050      2.00000
      3     -21.0503      2.00000
      4     -20.5573      2.00000
      5     -17.1500      2.00000
      6     -16.6741      2.00000
      7     -13.2604      2.00000
      8     -12.3434      2.00000
      9     -11.8280      2.00000
     10     -11.1837      2.00000
     11     -11.1079      2.00000
     12     -10.3943      2.00000
     13      -9.3225      2.00000
     14      -9.2704      2.00000
     15      -8.9298      2.00000
     16      -8.8205      2.00000
     17      -5.0966      2.00000
     18      -5.0241      2.00000
     19      -4.5403      2.00000
     20      -4.1825      2.00000
     21       1.8988      0.00000
     22       2.1696      0.00000
     23       2.6359      0.00000
     24       3.1581      0.00000
     25       3.1996      0.00000
     26       3.2932      0.00000
     27       3.4796      0.00000
     28       3.5636      0.00000

 k-point    34 :       0.5000    0.1333    0.0000
  band No.  band energies     occupation 
      1     -23.9383      2.00000
      2     -23.9374      2.00000
      3     -20.7996      2.00000
      4     -20.7987      2.00000
      5     -16.9569      2.00000
      6     -16.9546      2.00000
      7     -12.7464      2.00000
      8     -12.7441      2.00000
      9     -11.5066      2.00000
     10     -11.5052      2.00000
     11     -10.7595      2.00000
     12     -10.7583      2.00000
     13      -9.0613      2.00000
     14      -9.0598      2.00000
     15      -9.0528      2.00000
     16      -9.0514      2.00000
     17      -5.1150      2.00000
     18      -5.1106      2.00000
     19      -4.3653      2.00000
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     21       2.2824      0.00000
     22       2.2829      0.00000
     23       2.6422      0.00000
     24       2.6438      0.00000
     25       3.2406      0.00000
     26       3.2413      0.00000
     27       3.8354      0.00000
     28       3.8355      0.00000

 k-point    35 :      -0.4375    0.1333    0.0000
  band No.  band energies     occupation 
      1     -24.3252      2.00000
      2     -23.5050      2.00000
      3     -21.0503      2.00000
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     10     -11.1839      2.00000
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     12     -10.3940      2.00000
     13      -9.3213      2.00000
     14      -9.2701      2.00000
     15      -8.9309      2.00000
     16      -8.8210      2.00000
     17      -5.0968      2.00000
     18      -5.0238      2.00000
     19      -4.5411      2.00000
     20      -4.1817      2.00000
     21       1.8987      0.00000
     22       2.1695      0.00000
     23       2.6356      0.00000
     24       3.1583      0.00000
     25       3.2001      0.00000
     26       3.2931      0.00000
     27       3.4793      0.00000
     28       3.5635      0.00000

 k-point    36 :      -0.3750    0.1333    0.0000
  band No.  band energies     occupation 
      1     -24.6645      2.00000
      2     -23.0305      2.00000
      3     -21.2919      2.00000
      4     -20.3485      2.00000
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     10     -11.2808      2.00000
     11     -10.9080      2.00000
     12     -10.1299      2.00000
     13      -9.6704      2.00000
     14      -9.3766      2.00000
     15      -8.9766      2.00000
     16      -8.5856      2.00000
     17      -4.9721      2.00000
     18      -4.8531      2.00000
     19      -4.7084      2.00000
     20      -3.9966      2.00000
     21       1.5388      0.00000
     22       1.7526      0.00000
     23       2.8202      0.00000
     24       2.8833      0.00000
     25       3.0274      0.00000
     26       3.2732      0.00000
     27       3.4695      0.00000
     28       3.6708      0.00000

 k-point    37 :      -0.3125    0.1333    0.0000
  band No.  band energies     occupation 
      1     -24.9539      2.00000
      2     -22.5202      2.00000
      3     -21.5109      2.00000
      4     -20.1944      2.00000
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      9     -12.2706      2.00000
     10     -11.1844      2.00000
     11     -10.8394      2.00000
     12     -10.0477      2.00000
     13      -9.9096      2.00000
     14      -9.3060      2.00000
     15      -9.1734      2.00000
     16      -8.3620      2.00000
     17      -4.8595      2.00000
     18      -4.7669      2.00000
     19      -4.6306      2.00000
     20      -3.8115      2.00000
     21       1.2278      0.00000
     22       1.4002      0.00000
     23       2.4199      0.00000
     24       2.6136      0.00000
     25       2.8986      0.00000
     26       3.0982      0.00000
     27       3.4034      0.00000
     28       3.5245      0.00000

 k-point    38 :      -0.2500    0.1333    0.0000
  band No.  band energies     occupation 
      1     -25.1922      2.00000
      2     -21.9840      2.00000
      3     -21.6985      2.00000
      4     -20.1031      2.00000
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      8     -12.6654      2.00000
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     10     -11.1553      2.00000
     11     -11.0319      2.00000
     12     -10.0412      2.00000
     13      -9.8447      2.00000
     14      -9.4662      2.00000
     15      -9.1445      2.00000
     16      -8.1473      2.00000
     17      -4.9860      2.00000
     18      -4.5347      2.00000
     19      -4.3881      2.00000
     20      -3.6346      2.00000
     21       0.9771      0.00000
     22       1.1165      0.00000
     23       2.0926      0.00000
     24       2.2951      0.00000
     25       2.5927      0.00000
     26       3.0138      0.00000
     27       3.2323      0.00000
     28       3.2455      0.00000

 k-point    39 :      -0.1875    0.1333    0.0000
  band No.  band energies     occupation 
      1     -25.3784      2.00000
      2     -21.8490      2.00000
      3     -21.4398      2.00000
      4     -20.0636      2.00000
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      6     -15.9121      2.00000
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      8     -12.8964      2.00000
      9     -12.6661      2.00000
     10     -11.6287      2.00000
     11     -10.9552      2.00000
     12     -10.0001      2.00000
     13      -9.9115      2.00000
     14      -9.5563      2.00000
     15      -8.9840      2.00000
     16      -7.9491      2.00000
     17      -5.0808      2.00000
     18      -4.3297      2.00000
     19      -4.1570      2.00000
     20      -3.4791      2.00000
     21       0.7897      0.00000
     22       0.9017      0.00000
     23       1.8385      0.00000
     24       2.0466      0.00000
     25       2.3580      0.00000
     26       2.8015      0.00000
     27       2.9863      0.00000
     28       3.0815      0.00000

 k-point    40 :      -0.1250    0.1333    0.0000
  band No.  band energies     occupation 
      1     -25.5118      2.00000
      2     -21.9587      2.00000
      3     -20.9243      2.00000
      4     -20.0550      2.00000
      5     -16.5456      2.00000
      6     -16.4714      2.00000
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      8     -13.1105      2.00000
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     10     -12.0740      2.00000
     11     -10.9464      2.00000
     12     -10.2433      2.00000
     13      -9.9349      2.00000
     14      -9.3874      2.00000
     15      -8.8444      2.00000
     16      -7.7886      2.00000
     17      -5.1422      2.00000
     18      -4.1855      2.00000
     19      -3.9654      2.00000
     20      -3.3582      2.00000
     21       0.6628      0.00000
     22       0.7525      0.00000
     23       1.6572      0.00000
     24       1.8698      0.00000
     25       2.1924      0.00000
     26       2.6404      0.00000
     27       2.7792      0.00000
     28       2.8496      0.00000

 k-point    41 :      -0.0625    0.1333    0.0000
  band No.  band energies     occupation 
      1     -25.5920      2.00000
      2     -22.0253      2.00000
      3     -20.5151      2.00000
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      5     -17.0302      2.00000
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      8     -13.2928      2.00000
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     10     -12.3926      2.00000
     11     -10.9597      2.00000
     12     -10.5047      2.00000
     13      -9.8857      2.00000
     14      -9.2632      2.00000
     15      -8.7425      2.00000
     16      -7.6858      2.00000
     17      -5.1743      2.00000
     18      -4.1069      2.00000
     19      -3.8380      2.00000
     20      -3.2821      2.00000
     21       0.5906      0.00000
     22       0.6647      0.00000
     23       1.5486      0.00000
     24       1.7643      0.00000
     25       2.0938      0.00000
     26       2.5453      0.00000
     27       2.6304      0.00000
     28       2.6566      0.00000

 k-point    42 :       0.0000    0.2000    0.0000
  band No.  band energies     occupation 
      1     -25.4972      2.00000
      2     -22.5093      2.00000
      3     -20.2543      2.00000
      4     -19.7323      2.00000
      5     -17.1760      2.00000
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      8     -13.3795      2.00000
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     10     -12.5513      2.00000
     11     -10.9478      2.00000
     12     -10.2634      2.00000
     13      -9.8424      2.00000
     14      -9.1047      2.00000
     15      -8.9352      2.00000
     16      -7.6253      2.00000
     17      -5.2554      2.00000
     18      -4.1295      2.00000
     19      -3.8940      2.00000
     20      -3.3650      2.00000
     21       0.6811      0.00000
     22       0.7386      0.00000
     23       1.6864      0.00000
     24       1.9015      0.00000
     25       2.1824      0.00000
     26       2.6226      0.00000
     27       2.6843      0.00000
     28       2.6925      0.00000

 k-point    43 :       0.0625    0.2000    0.0000
  band No.  band energies     occupation 
      1     -25.4705      2.00000
      2     -22.4858      2.00000
      3     -20.4193      2.00000
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      8     -13.2706      2.00000
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     10     -12.4641      2.00000
     11     -10.9590      2.00000
     12     -10.1718      2.00000
     13      -9.8573      2.00000
     14      -9.1419      2.00000
     15      -8.9569      2.00000
     16      -7.6549      2.00000
     17      -5.2511      2.00000
     18      -4.1523      2.00000
     19      -3.9374      2.00000
     20      -3.3932      2.00000
     21       0.7052      0.00000
     22       0.7666      0.00000
     23       1.7225      0.00000
     24       1.9368      0.00000
     25       2.2133      0.00000
     26       2.6819      0.00000
     27       2.7277      0.00000
     28       2.7286      0.00000

 k-point    44 :       0.1250    0.2000    0.0000
  band No.  band energies     occupation 
      1     -25.3904      2.00000
      2     -22.4156      2.00000
      3     -20.8246      2.00000
      4     -19.7863      2.00000
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      7     -14.2079      2.00000
      8     -13.0490      2.00000
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     10     -12.2221      2.00000
     11     -11.0051      2.00000
     12      -9.9375      2.00000
     13      -9.8914      2.00000
     14      -9.2459      2.00000
     15      -9.0107      2.00000
     16      -7.7469      2.00000
     17      -5.2337      2.00000
     18      -4.2267      2.00000
     19      -4.0603      2.00000
     20      -3.4756      2.00000
     21       0.7800      0.00000
     22       0.8509      0.00000
     23       1.8306      0.00000
     24       2.0428      0.00000
     25       2.3060      0.00000
     26       2.7990      0.00000
     27       2.8313      0.00000
     28       2.8948      0.00000

 k-point    45 :       0.1875    0.2000    0.0000
  band No.  band energies     occupation 
      1     -25.2574      2.00000
      2     -22.2995      2.00000
      3     -21.3361      2.00000
      4     -19.8740      2.00000
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      8     -12.8743      2.00000
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     10     -11.8404      2.00000
     11     -11.1154      2.00000
     12      -9.9143      2.00000
     13      -9.6828      2.00000
     14      -9.3586      2.00000
     15      -9.0792      2.00000
     16      -7.9029      2.00000
     17      -5.1928      2.00000
     18      -4.3636      2.00000
     19      -4.2439      2.00000
     20      -3.6049      2.00000
     21       0.9106      0.00000
     22       0.9931      0.00000
     23       2.0108      0.00000
     24       2.2201      0.00000
     25       2.4609      0.00000
     26       2.9611      0.00000
     27       2.9925      0.00000
     28       3.1148      0.00000

 k-point    46 :       0.2500    0.2000    0.0000
  band No.  band energies     occupation 
      1     -25.0717      2.00000
      2     -22.1392      2.00000
      3     -21.8766      2.00000
      4     -20.0245      2.00000
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      8     -12.6336      2.00000
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     10     -11.3696      2.00000
     11     -11.3053      2.00000
     12      -9.8959      2.00000
     13      -9.7227      2.00000
     14      -9.2146      2.00000
     15      -9.1623      2.00000
     16      -8.1116      2.00000
     17      -5.1203      2.00000
     18      -4.5602      2.00000
     19      -4.4648      2.00000
     20      -3.7697      2.00000
     21       1.1021      0.00000
     22       1.1976      0.00000
     23       2.2634      0.00000
     24       2.4689      0.00000
     25       2.6817      0.00000
     26       3.1167      0.00000
     27       3.2156      0.00000
     28       3.2813      0.00000

 k-point    47 :       0.3125    0.2000    0.0000
  band No.  band energies     occupation 
      1     -24.8341      2.00000
      2     -22.4099      2.00000
      3     -21.9370      2.00000
      4     -20.2429      2.00000
      5     -17.1367      2.00000
      6     -15.4957      2.00000
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      8     -12.3706      2.00000
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     10     -11.5194      2.00000
     11     -10.9435      2.00000
     12      -9.8648      2.00000
     13      -9.8566      2.00000
     14      -9.2639      2.00000
     15      -8.9909      2.00000
     16      -8.3461      2.00000
     17      -5.0150      2.00000
     18      -4.7853      2.00000
     19      -4.6979      2.00000
     20      -3.9559      2.00000
     21       1.3561      0.00000
     22       1.4688      0.00000
     23       2.5885      0.00000
     24       2.7837      0.00000
     25       2.9725      0.00000
     26       3.0410      0.00000
     27       3.5034      0.00000
     28       3.5518      0.00000

 k-point    48 :       0.3750    0.2000    0.0000
  band No.  band energies     occupation 
      1     -24.5455      2.00000
      2     -22.9177      2.00000
      3     -21.6967      2.00000
      4     -20.5155      2.00000
      5     -17.0577      2.00000
      6     -15.9118      2.00000
      7     -14.0420      2.00000
      8     -12.3202      2.00000
      9     -11.9045      2.00000
     10     -11.5023      2.00000
     11     -10.8168      2.00000
     12      -9.9240      2.00000
     13      -9.7663      2.00000
     14      -9.3085      2.00000
     15      -8.8742      2.00000
     16      -8.5783      2.00000
     17      -4.9888      2.00000
     18      -4.9112      2.00000
     19      -4.8801      2.00000
     20      -4.1513      2.00000
     21       1.6686      0.00000
     22       1.8078      0.00000
     23       2.8564      0.00000
     24       2.9857      0.00000
     25       3.1927      0.00000
     26       3.3273      0.00000
     27       3.6110      0.00000
     28       3.6438      0.00000

 k-point    49 :       0.4375    0.2000    0.0000
  band No.  band energies     occupation 
      1     -24.2073      2.00000
      2     -23.3902      2.00000
      3     -21.4239      2.00000
      4     -20.8181      2.00000
      5     -16.8785      2.00000
      6     -16.2900      2.00000
      7     -13.5070      2.00000
      8     -12.6124      2.00000
      9     -11.6062      2.00000
     10     -11.1285      2.00000
     11     -11.0083      2.00000
     12     -10.2195      2.00000
     13      -9.4315      2.00000
     14      -9.2012      2.00000
     15      -8.9116      2.00000
     16      -8.7996      2.00000
     17      -5.1199      2.00000
     18      -5.0709      2.00000
     19      -4.7200      2.00000
     20      -4.3482      2.00000
     21       2.0274      0.00000
     22       2.2098      0.00000
     23       2.7041      0.00000
     24       3.1498      0.00000
     25       3.3073      0.00000
     26       3.4545      0.00000
     27       3.6270      0.00000
     28       3.7366      0.00000

 k-point    50 :       0.5000    0.2000    0.0000
  band No.  band energies     occupation 
      1     -23.8218      2.00000
      2     -23.8209      2.00000
      3     -21.1271      2.00000
      4     -21.1266      2.00000
      5     -16.6179      2.00000
      6     -16.6161      2.00000
      7     -13.0300      2.00000
      8     -13.0282      2.00000
      9     -11.2998      2.00000
     10     -11.2985      2.00000
     11     -10.6571      2.00000
     12     -10.6559      2.00000
     13      -9.1104      2.00000
     14      -9.1090      2.00000
     15      -9.0132      2.00000
     16      -9.0118      2.00000
     17      -5.1494      2.00000
     18      -5.1454      2.00000
     19      -4.5413      2.00000
     20      -4.5391      2.00000
     21       2.4040      0.00000
     22       2.4048      0.00000
     23       2.6638      0.00000
     24       2.6652      0.00000
     25       3.3482      0.00000
     26       3.3490      0.00000
     27       3.9780      0.00000
     28       3.9783      0.00000

 k-point    51 :      -0.4375    0.2000    0.0000
  band No.  band energies     occupation 
      1     -24.2073      2.00000
      2     -23.3902      2.00000
      3     -21.4239      2.00000
      4     -20.8181      2.00000
      5     -16.8780      2.00000
      6     -16.2905      2.00000
      7     -13.5066      2.00000
      8     -12.6131      2.00000
      9     -11.6060      2.00000
     10     -11.1284      2.00000
     11     -11.0086      2.00000
     12     -10.2190      2.00000
     13      -9.4301      2.00000
     14      -9.2008      2.00000
     15      -8.9128      2.00000
     16      -8.8003      2.00000
     17      -5.1200      2.00000
     18      -5.0708      2.00000
     19      -4.7210      2.00000
     20      -4.3472      2.00000
     21       2.0272      0.00000
     22       2.2097      0.00000
     23       2.7039      0.00000
     24       3.1501      0.00000
     25       3.3077      0.00000
     26       3.4544      0.00000
     27       3.6267      0.00000
     28       3.7366      0.00000

 k-point    52 :      -0.3750    0.2000    0.0000
  band No.  band energies     occupation 
      1     -24.5455      2.00000
      2     -22.9177      2.00000
      3     -21.6967      2.00000
      4     -20.5156      2.00000
      5     -17.0573      2.00000
      6     -15.9124      2.00000
      7     -14.0418      2.00000
      8     -12.3211      2.00000
      9     -11.9044      2.00000
     10     -11.5020      2.00000
     11     -10.8170      2.00000
     12      -9.9228      2.00000
     13      -9.7649      2.00000
     14      -9.3087      2.00000
     15      -8.8752      2.00000
     16      -8.5791      2.00000
     17      -4.9889      2.00000
     18      -4.9110      2.00000
     19      -4.8812      2.00000
     20      -4.1504      2.00000
     21       1.6683      0.00000
     22       1.8077      0.00000
     23       2.8561      0.00000
     24       2.9857      0.00000
     25       3.1927      0.00000
     26       3.3270      0.00000
     27       3.6114      0.00000
     28       3.6440      0.00000

 k-point    53 :      -0.3125    0.2000    0.0000
  band No.  band energies     occupation 
      1     -24.8341      2.00000
      2     -22.4099      2.00000
      3     -21.9370      2.00000
      4     -20.2430      2.00000
      5     -17.1363      2.00000
      6     -15.4963      2.00000
      7     -14.6349      2.00000
      8     -12.3712      2.00000
      9     -12.1864      2.00000
     10     -11.5194      2.00000
     11     -10.9431      2.00000
     12      -9.8640      2.00000
     13      -9.8549      2.00000
     14      -9.2645      2.00000
     15      -8.9917      2.00000
     16      -8.3467      2.00000
     17      -5.0161      2.00000
     18      -4.7854      2.00000
     19      -4.6976      2.00000
     20      -3.9550      2.00000
     21       1.3559      0.00000
     22       1.4687      0.00000
     23       2.5884      0.00000
     24       2.7836      0.00000
     25       2.9723      0.00000
     26       3.0406      0.00000
     27       3.5034      0.00000
     28       3.5525      0.00000

 k-point    54 :      -0.2500    0.2000    0.0000
  band No.  band energies     occupation 
      1     -25.0717      2.00000
      2     -22.1392      2.00000
      3     -21.8766      2.00000
      4     -20.0246      2.00000
      5     -17.1013      2.00000
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     10     -11.3684      2.00000
     11     -11.3057      2.00000
     12      -9.8943      2.00000
     13      -9.7227      2.00000
     14      -9.2151      2.00000
     15      -9.1629      2.00000
     16      -8.1121      2.00000
     17      -5.1214      2.00000
     18      -4.5605      2.00000
     19      -4.4642      2.00000
     20      -3.7690      2.00000
     21       1.1019      0.00000
     22       1.1975      0.00000
     23       2.2633      0.00000
     24       2.4689      0.00000
     25       2.6816      0.00000
     26       3.1160      0.00000
     27       3.2157      0.00000
     28       3.2849      0.00000

 k-point    55 :      -0.1875    0.2000    0.0000
  band No.  band energies     occupation 
      1     -25.2574      2.00000
      2     -22.2995      2.00000
      3     -21.3361      2.00000
      4     -19.8741      2.00000
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      9     -12.7264      2.00000
     10     -11.8388      2.00000
     11     -11.1160      2.00000
     12      -9.9127      2.00000
     13      -9.6840      2.00000
     14      -9.3580      2.00000
     15      -9.0797      2.00000
     16      -7.9033      2.00000
     17      -5.1937      2.00000
     18      -4.3641      2.00000
     19      -4.2433      2.00000
     20      -3.6044      2.00000
     21       0.9104      0.00000
     22       0.9931      0.00000
     23       2.0108      0.00000
     24       2.2201      0.00000
     25       2.4608      0.00000
     26       2.9608      0.00000
     27       2.9927      0.00000
     28       3.1150      0.00000

 k-point    56 :      -0.1250    0.2000    0.0000
  band No.  band energies     occupation 
      1     -25.3904      2.00000
      2     -22.4156      2.00000
      3     -20.8246      2.00000
      4     -19.7864      2.00000
      5     -16.7488      2.00000
      6     -16.5232      2.00000
      7     -14.2090      2.00000
      8     -13.0491      2.00000
      9     -13.0138      2.00000
     10     -12.2203      2.00000
     11     -11.0056      2.00000
     12      -9.9384      2.00000
     13      -9.8902      2.00000
     14      -9.2454      2.00000
     15      -9.0111      2.00000
     16      -7.7471      2.00000
     17      -5.2344      2.00000
     18      -4.2271      2.00000
     19      -4.0598      2.00000
     20      -3.4752      2.00000
     21       0.7799      0.00000
     22       0.8508      0.00000
     23       1.8306      0.00000
     24       2.0427      0.00000
     25       2.3059      0.00000
     26       2.7990      0.00000
     27       2.8315      0.00000
     28       2.8950      0.00000

 k-point    57 :      -0.0625    0.2000    0.0000
  band No.  band energies     occupation 
      1     -25.4705      2.00000
      2     -22.4858      2.00000
      3     -20.4193      2.00000
      4     -19.7443      2.00000
      5     -16.9897      2.00000
      6     -16.5525      2.00000
      7     -13.8909      2.00000
      8     -13.2708      2.00000
      9     -13.1533      2.00000
     10     -12.4628      2.00000
     11     -10.9593      2.00000
     12     -10.1724      2.00000
     13      -9.8567      2.00000
     14      -9.1417      2.00000
     15      -8.9571      2.00000
     16      -7.6550      2.00000
     17      -5.2515      2.00000
     18      -4.1525      2.00000
     19      -3.9371      2.00000
     20      -3.3930      2.00000
     21       0.7052      0.00000
     22       0.7666      0.00000
     23       1.7225      0.00000
     24       1.9368      0.00000
     25       2.2133      0.00000
     26       2.6821      0.00000
     27       2.7276      0.00000
     28       2.7287      0.00000

 k-point    58 :       0.0000    0.2667    0.0000
  band No.  band energies     occupation 
      1     -25.3279      2.00000
      2     -22.9675      2.00000
      3     -20.1267      2.00000
      4     -19.4868      2.00000
      5     -17.1216      2.00000
      6     -16.7502      2.00000
      7     -13.5491      2.00000
      8     -13.4700      2.00000
      9     -13.2955      2.00000
     10     -12.3423      2.00000
     11     -10.9884      2.00000
     12      -9.9455      2.00000
     13      -9.8525      2.00000
     14      -9.1994      2.00000
     15      -8.9446      2.00000
     16      -7.6224      2.00000
     17      -5.3040      2.00000
     18      -4.1927      2.00000
     19      -4.0438      2.00000
     20      -3.5097      2.00000
     21       0.8497      0.00000
     22       0.8961      0.00000
     23       1.9302      0.00000
     24       2.1437      0.00000
     25       2.3517      0.00000
     26       2.7127      0.00000
     27       2.8545      0.00000
     28       2.9179      0.00000

 k-point    59 :       0.0625    0.2667    0.0000
  band No.  band energies     occupation 
      1     -25.3013      2.00000
      2     -22.9432      2.00000
      3     -20.2888      2.00000
      4     -19.5219      2.00000
      5     -16.9454      2.00000
      6     -16.8039      2.00000
      7     -13.4527      2.00000
      8     -13.4271      2.00000
      9     -13.3961      2.00000
     10     -12.2741      2.00000
     11     -11.0255      2.00000
     12      -9.8679      2.00000
     13      -9.8589      2.00000
     14      -9.2019      2.00000
     15      -8.9700      2.00000
     16      -7.6452      2.00000
     17      -5.3068      2.00000
     18      -4.2138      2.00000
     19      -4.0866      2.00000
     20      -3.5402      2.00000
     21       0.8750      0.00000
     22       0.9230      0.00000
     23       1.9660      0.00000
     24       2.1792      0.00000
     25       2.3809      0.00000
     26       2.7741      0.00000
     27       2.8852      0.00000
     28       2.9513      0.00000

 k-point    60 :       0.1250    0.2667    0.0000
  band No.  band energies     occupation 
      1     -25.2216      2.00000
      2     -22.8704      2.00000
      3     -20.6883      2.00000
      4     -19.6321      2.00000
      5     -16.9191      2.00000
      6     -16.5079      2.00000
      7     -13.7506      2.00000
      8     -13.2967      2.00000
      9     -13.0876      2.00000
     10     -12.1072      2.00000
     11     -11.1443      2.00000
     12      -9.8640      2.00000
     13      -9.6799      2.00000
     14      -9.2056      2.00000
     15      -9.0353      2.00000
     16      -7.7217      2.00000
     17      -5.3093      2.00000
     18      -4.2812      2.00000
     19      -4.2078      2.00000
     20      -3.6286      2.00000
     21       0.9529      0.00000
     22       1.0036      0.00000
     23       2.0732      0.00000
     24       2.2858      0.00000
     25       2.4675      0.00000
     26       2.9314      0.00000
     27       2.9659      0.00000
     28       3.0897      0.00000

 k-point    61 :       0.1875    0.2667    0.0000
  band No.  band energies     occupation 
      1     -25.0891      2.00000
      2     -22.7498      2.00000
      3     -21.1935      2.00000
      4     -19.8250      2.00000
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      6     -15.9518      2.00000
      7     -14.1594      2.00000
      8     -13.0757      2.00000
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     10     -11.8574      2.00000
     11     -11.3517      2.00000
     12      -9.8413      2.00000
     13      -9.5196      2.00000
     14      -9.2080      2.00000
     15      -9.0726      2.00000
     16      -7.8650      2.00000
     17      -5.2968      2.00000
     18      -4.4066      2.00000
     19      -4.3866      2.00000
     20      -3.7660      2.00000
     21       1.0879      0.00000
     22       1.1383      0.00000
     23       2.2514      0.00000
     24       2.4638      0.00000
     25       2.6099      0.00000
     26       3.0698      0.00000
     27       3.0896      0.00000
     28       3.2203      0.00000

 k-point    62 :       0.2500    0.2667    0.0000
  band No.  band energies     occupation 
      1     -24.9041      2.00000
      2     -22.5825      2.00000
      3     -21.7286      2.00000
      4     -20.0961      2.00000
      5     -17.0245      2.00000
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      8     -12.7697      2.00000
      9     -12.2610      2.00000
     10     -11.6248      2.00000
     11     -11.4970      2.00000
     12      -9.7830      2.00000
     13      -9.5695      2.00000
     14      -9.2180      2.00000
     15      -8.9603      2.00000
     16      -8.0753      2.00000
     17      -5.2569      2.00000
     18      -4.6106      2.00000
     19      -4.5785      2.00000
     20      -3.9392      2.00000
     21       1.2838      0.00000
     22       1.3306      0.00000
     23       2.5001      0.00000
     24       2.7123      0.00000
     25       2.8123      0.00000
     26       3.0976      0.00000
     27       3.2332      0.00000
     28       3.4416      0.00000

 k-point    63 :       0.3125    0.2667    0.0000
  band No.  band energies     occupation 
      1     -24.6675      2.00000
      2     -22.3703      2.00000
      3     -22.2573      2.00000
      4     -20.4245      2.00000
      5     -16.9433      2.00000
      6     -15.0477      2.00000
      7     -14.8098      2.00000
      8     -12.4711      2.00000
      9     -11.9229      2.00000
     10     -11.8470      2.00000
     11     -11.0661      2.00000
     12      -9.7229      2.00000
     13      -9.7214      2.00000
     14      -9.2454      2.00000
     15      -8.8254      2.00000
     16      -8.3295      2.00000
     17      -5.1836      2.00000
     18      -4.8330      2.00000
     19      -4.7943      2.00000
     20      -4.1341      2.00000
     21       1.5410      0.00000
     22       1.5869      0.00000
     23       2.8191      0.00000
     24       2.9377      0.00000
     25       3.0609      0.00000
     26       3.0866      0.00000
     27       3.4775      0.00000
     28       3.7285      0.00000

 k-point    64 :       0.3750    0.2667    0.0000
  band No.  band energies     occupation 
      1     -24.3802      2.00000
      2     -22.7614      2.00000
      3     -22.1158      2.00000
      4     -20.7826      2.00000
      5     -16.7750      2.00000
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      8     -12.5818      2.00000
      9     -11.6185      2.00000
     10     -11.6104      2.00000
     11     -10.7633      2.00000
     12      -9.7789      2.00000
     13      -9.7623      2.00000
     14      -9.2414      2.00000
     15      -8.7961      2.00000
     16      -8.5808      2.00000
     17      -5.0748      2.00000
     18      -5.0305      2.00000
     19      -5.0008      2.00000
     20      -4.3399      2.00000
     21       1.8540      0.00000
     22       1.9101      0.00000
     23       2.8512      0.00000
     24       3.2052      0.00000
     25       3.4114      0.00000
     26       3.4350      0.00000
     27       3.6098      0.00000
     28       3.8231      0.00000

 k-point    65 :       0.4375    0.2667    0.0000
  band No.  band energies     occupation 
      1     -24.0436      2.00000
      2     -23.2309      2.00000
      3     -21.8227      2.00000
      4     -21.1459      2.00000
      5     -16.5326      2.00000
      6     -15.8726      2.00000
      7     -13.8169      2.00000
      8     -12.9506      2.00000
      9     -11.3223      2.00000
     10     -11.0910      2.00000
     11     -10.8024      2.00000
     12     -10.0759      2.00000
     13      -9.5186      2.00000
     14      -9.1355      2.00000
     15      -8.9149      2.00000
     16      -8.7933      2.00000
     17      -5.1674      2.00000
     18      -5.1495      2.00000
     19      -4.9288      2.00000
     20      -4.5488      2.00000
     21       2.2108      0.00000
     22       2.2956      0.00000
     23       2.8142      0.00000
     24       3.1795      0.00000
     25       3.4448      0.00000
     26       3.6656      0.00000
     27       3.8331      0.00000
     28       3.8805      0.00000

 k-point    66 :       0.5000    0.2667    0.0000
  band No.  band energies     occupation 
      1     -23.6600      2.00000
      2     -23.6592      2.00000
      3     -21.4968      2.00000
      4     -21.4966      2.00000
      5     -16.2289      2.00000
      6     -16.2277      2.00000
      7     -13.3714      2.00000
      8     -13.3699      2.00000
      9     -11.0375      2.00000
     10     -11.0361      2.00000
     11     -10.5472      2.00000
     12     -10.5460      2.00000
     13      -9.1774      2.00000
     14      -9.1759      2.00000
     15      -8.9759      2.00000
     16      -8.9747      2.00000
     17      -5.2118      2.00000
     18      -5.2081      2.00000
     19      -4.7506      2.00000
     20      -4.7489      2.00000
     21       2.5807      0.00000
     22       2.5819      0.00000
     23       2.7292      0.00000
     24       2.7302      0.00000
     25       3.4885      0.00000
     26       3.4892      0.00000
     27       4.1223      0.00000
     28       4.1230      0.00000

 k-point    67 :      -0.4375    0.2667    0.0000
  band No.  band energies     occupation 
      1     -24.0436      2.00000
      2     -23.2309      2.00000
      3     -21.8227      2.00000
      4     -21.1460      2.00000
      5     -16.5322      2.00000
      6     -15.8731      2.00000
      7     -13.8166      2.00000
      8     -12.9510      2.00000
      9     -11.3222      2.00000
     10     -11.0911      2.00000
     11     -10.8026      2.00000
     12     -10.0753      2.00000
     13      -9.5172      2.00000
     14      -9.1351      2.00000
     15      -8.9161      2.00000
     16      -8.7940      2.00000
     17      -5.1650      2.00000
     18      -5.1518      2.00000
     19      -4.9300      2.00000
     20      -4.5477      2.00000
     21       2.2106      0.00000
     22       2.2955      0.00000
     23       2.8140      0.00000
     24       3.1798      0.00000
     25       3.4451      0.00000
     26       3.6655      0.00000
     27       3.8332      0.00000
     28       3.8801      0.00000

 k-point    68 :      -0.3750    0.2667    0.0000
  band No.  band energies     occupation 
      1     -24.3802      2.00000
      2     -22.7614      2.00000
      3     -22.1157      2.00000
      4     -20.7826      2.00000
      5     -16.7746      2.00000
      6     -15.4762      2.00000
      7     -14.2929      2.00000
      8     -12.5825      2.00000
      9     -11.6186      2.00000
     10     -11.6102      2.00000
     11     -10.7630      2.00000
     12      -9.7777      2.00000
     13      -9.7612      2.00000
     14      -9.2417      2.00000
     15      -8.7971      2.00000
     16      -8.5816      2.00000
     17      -5.0761      2.00000
     18      -5.0281      2.00000
     19      -5.0030      2.00000
     20      -4.3389      2.00000
     21       1.8537      0.00000
     22       1.9100      0.00000
     23       2.8510      0.00000
     24       3.2051      0.00000
     25       3.4112      0.00000
     26       3.4350      0.00000
     27       3.6104      0.00000
     28       3.8231      0.00000

 k-point    69 :      -0.3125    0.2667    0.0000
  band No.  band energies     occupation 
      1     -24.6675      2.00000
      2     -22.3703      2.00000
      3     -22.2573      2.00000
      4     -20.4246      2.00000
      5     -16.9429      2.00000
      6     -15.0483      2.00000
      7     -14.8097      2.00000
      8     -12.4719      2.00000
      9     -11.9232      2.00000
     10     -11.8467      2.00000
     11     -11.0649      2.00000
     12      -9.7222      2.00000
     13      -9.7199      2.00000
     14      -9.2464      2.00000
     15      -8.8261      2.00000
     16      -8.3301      2.00000
     17      -5.1849      2.00000
     18      -4.8311      2.00000
     19      -4.7958      2.00000
     20      -4.1331      2.00000
     21       1.5407      0.00000
     22       1.5868      0.00000
     23       2.8190      0.00000
     24       2.9374      0.00000
     25       3.0609      0.00000
     26       3.0864      0.00000
     27       3.4776      0.00000
     28       3.7274      0.00000

 k-point    70 :      -0.2500    0.2667    0.0000
  band No.  band energies     occupation 
      1     -24.9041      2.00000
      2     -22.5825      2.00000
      3     -21.7286      2.00000
      4     -20.0962      2.00000
      5     -17.0242      2.00000
      6     -15.3692      2.00000
      7     -14.6031      2.00000
      8     -12.7701      2.00000
      9     -12.2617      2.00000
     10     -11.6251      2.00000
     11     -11.4951      2.00000
     12      -9.7811      2.00000
     13      -9.5698      2.00000
     14      -9.2190      2.00000
     15      -8.9606      2.00000
     16      -8.0758      2.00000
     17      -5.2582      2.00000
     18      -4.6093      2.00000
     19      -4.5795      2.00000
     20      -3.9383      2.00000
     21       1.2836      0.00000
     22       1.3306      0.00000
     23       2.5001      0.00000
     24       2.7122      0.00000
     25       2.8122      0.00000
     26       3.0972      0.00000
     27       3.2334      0.00000
     28       3.4406      0.00000

 k-point    71 :      -0.1875    0.2667    0.0000
  band No.  band energies     occupation 
      1     -25.0891      2.00000
      2     -22.7498      2.00000
      3     -21.1935      2.00000
      4     -19.8251      2.00000
      5     -17.0110      2.00000
      6     -15.9518      2.00000
      7     -14.1603      2.00000
      8     -13.0758      2.00000
      9     -12.6652      2.00000
     10     -11.8551      2.00000
     11     -11.3521      2.00000
     12      -9.8395      2.00000
     13      -9.5207      2.00000
     14      -9.2090      2.00000
     15      -9.0720      2.00000
     16      -7.8653      2.00000
     17      -5.2979      2.00000
     18      -4.4068      2.00000
     19      -4.3862      2.00000
     20      -3.7653      2.00000
     21       1.0877      0.00000
     22       1.1383      0.00000
     23       2.2514      0.00000
     24       2.4638      0.00000
     25       2.6098      0.00000
     26       3.0704      0.00000
     27       3.0894      0.00000
     28       3.2192      0.00000

 k-point    72 :      -0.1250    0.2667    0.0000
  band No.  band energies     occupation 
      1     -25.2216      2.00000
      2     -22.8704      2.00000
      3     -20.6882      2.00000
      4     -19.6322      2.00000
      5     -16.9189      2.00000
      6     -16.5079      2.00000
      7     -13.7517      2.00000
      8     -13.2968      2.00000
      9     -13.0881      2.00000
     10     -12.1051      2.00000
     11     -11.1448      2.00000
     12      -9.8624      2.00000
     13      -9.6810      2.00000
     14      -9.2065      2.00000
     15      -9.0347      2.00000
     16      -7.7219      2.00000
     17      -5.3100      2.00000
     18      -4.2816      2.00000
     19      -4.2073      2.00000
     20      -3.6281      2.00000
     21       0.9527      0.00000
     22       1.0036      0.00000
     23       2.0732      0.00000
     24       2.2858      0.00000
     25       2.4674      0.00000
     26       2.9315      0.00000
     27       2.9664      0.00000
     28       3.0900      0.00000

 k-point    73 :      -0.0625    0.2667    0.0000
  band No.  band energies     occupation 
      1     -25.3013      2.00000
      2     -22.9432      2.00000
      3     -20.2888      2.00000
      4     -19.5219      2.00000
      5     -16.9454      2.00000
      6     -16.8037      2.00000
      7     -13.4540      2.00000
      8     -13.4271      2.00000
      9     -13.3960      2.00000
     10     -12.2727      2.00000
     11     -11.0258      2.00000
     12      -9.8685      2.00000
     13      -9.8581      2.00000
     14      -9.2024      2.00000
     15      -8.9697      2.00000
     16      -7.6453      2.00000
     17      -5.3072      2.00000
     18      -4.2140      2.00000
     19      -4.0863      2.00000
     20      -3.5400      2.00000
     21       0.8749      0.00000
     22       0.9230      0.00000
     23       1.9660      0.00000
     24       2.1792      0.00000
     25       2.3808      0.00000
     26       2.7742      0.00000
     27       2.8853      0.00000
     28       2.9506      0.00000

 k-point    74 :       0.0000    0.3333    0.0000
  band No.  band energies     occupation 
      1     -25.1122      2.00000
      2     -23.4080      2.00000
      3     -19.9708      2.00000
      4     -19.3577      2.00000
      5     -17.0710      2.00000
      6     -16.9341      2.00000
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      8     -13.7235      2.00000
      9     -12.8450      2.00000
     10     -11.9866      2.00000
     11     -11.1158      2.00000
     12      -9.9534      2.00000
     13      -9.7006      2.00000
     14      -9.4268      2.00000
     15      -8.7336      2.00000
     16      -7.6636      2.00000
     17      -5.2952      2.00000
     18      -4.3159      2.00000
     19      -4.1750      2.00000
     20      -3.6785      2.00000
     21       1.0766      0.00000
     22       1.1252      0.00000
     23       2.2430      0.00000
     24       2.4543      0.00000
     25       2.5644      0.00000
     26       2.7824      0.00000
     27       3.0184      0.00000
     28       3.1887      0.00000

 k-point    75 :       0.0625    0.3333    0.0000
  band No.  band energies     occupation 
      1     -25.0857      2.00000
      2     -23.3830      2.00000
      3     -20.1287      2.00000
      4     -19.4241      2.00000
      5     -16.9473      2.00000
      6     -16.9101      2.00000
      7     -13.6692      2.00000
      8     -13.6254      2.00000
      9     -12.9776      2.00000
     10     -11.9223      2.00000
     11     -11.1820      2.00000
     12      -9.9415      2.00000
     13      -9.6421      2.00000
     14      -9.4162      2.00000
     15      -8.7427      2.00000
     16      -7.6783      2.00000
     17      -5.3061      2.00000
     18      -4.3428      2.00000
     19      -4.2105      2.00000
     20      -3.7108      2.00000
     21       1.1031      0.00000
     22       1.1515      0.00000
     23       2.2783      0.00000
     24       2.4903      0.00000
     25       2.5926      0.00000
     26       2.8310      0.00000
     27       3.0352      0.00000
     28       3.1922      0.00000

 k-point    76 :       0.1250    0.3333    0.0000
  band No.  band energies     occupation 
      1     -25.0064      2.00000
      2     -23.3083      2.00000
      3     -20.5191      2.00000
      4     -19.6171      2.00000
      5     -16.9600      2.00000
      6     -16.5153      2.00000
      7     -13.5042      2.00000
      8     -13.3052      2.00000
      9     -13.2726      2.00000
     10     -11.7787      2.00000
     11     -11.3710      2.00000
     12      -9.9024      2.00000
     13      -9.5094      2.00000
     14      -9.3868      2.00000
     15      -8.7617      2.00000
     16      -7.7342      2.00000
     17      -5.3318      2.00000
     18      -4.4302      2.00000
     19      -4.3054      2.00000
     20      -3.8036      2.00000
     21       1.1843      0.00000
     22       1.2297      0.00000
     23       2.3837      0.00000
     24       2.5979      0.00000
     25       2.6751      0.00000
     26       2.9498      0.00000
     27       3.0499      0.00000
     28       3.2402      0.00000

 k-point    77 :       0.1875    0.3333    0.0000
  band No.  band energies     occupation 
      1     -24.8745      2.00000
      2     -23.1843      2.00000
      3     -21.0151      2.00000
      4     -19.9148      2.00000
      5     -16.9280      2.00000
      6     -16.0247      2.00000
      7     -13.7061      2.00000
      8     -13.2255      2.00000
      9     -12.7961      2.00000
     10     -11.6538      2.00000
     11     -11.5940      2.00000
     12      -9.8357      2.00000
     13      -9.4061      2.00000
     14      -9.3437      2.00000
     15      -8.7595      2.00000
     16      -7.8548      2.00000
     17      -5.3544      2.00000
     18      -4.5841      2.00000
     19      -4.4408      2.00000
     20      -3.9464      2.00000
     21       1.3236      0.00000
     22       1.3585      0.00000
     23       2.5568      0.00000
     24       2.7768      0.00000
     25       2.8022      0.00000
     26       3.0453      0.00000
     27       3.0647      0.00000
     28       3.3832      0.00000

 k-point    78 :       0.2500    0.3333    0.0000
  band No.  band energies     occupation 
      1     -24.6906      2.00000
      2     -23.0120      2.00000
      3     -21.5423      2.00000
      4     -20.2831      2.00000
      5     -16.8294      2.00000
      6     -15.5232      2.00000
      7     -14.1493      2.00000
      8     -12.8509      2.00000
      9     -12.2581      2.00000
     10     -11.9787      2.00000
     11     -11.3610      2.00000
     12      -9.7521      2.00000
     13      -9.4233      2.00000
     14      -9.2957      2.00000
     15      -8.7126      2.00000
     16      -8.0531      2.00000
     17      -5.3570      2.00000
     18      -4.7820      2.00000
     19      -4.6162      2.00000
     20      -4.1251      2.00000
     21       1.5236      0.00000
     22       1.5399      0.00000
     23       2.7896      0.00000
     24       2.9678      0.00000
     25       2.9822      0.00000
     26       3.0466      0.00000
     27       3.1877      0.00000
     28       3.6012      0.00000

 k-point    79 :       0.3125    0.3333    0.0000
  band No.  band energies     occupation 
      1     -24.4553      2.00000
      2     -22.7927      2.00000
      3     -22.0645      2.00000
      4     -20.6871      2.00000
      5     -16.6626      2.00000
      6     -15.0466      2.00000
      7     -14.5979      2.00000
      8     -12.6228      2.00000
      9     -12.0886      2.00000
     10     -11.7522      2.00000
     11     -11.0615      2.00000
     12      -9.6855      2.00000
     13      -9.5371      2.00000
     14      -9.2495      2.00000
     15      -8.6807      2.00000
     16      -8.3168      2.00000
     17      -5.3277      2.00000
     18      -4.9862      2.00000
     19      -4.8263      2.00000
     20      -4.3264      2.00000
     21       1.7814      0.00000
     22       1.7827      0.00000
     23       2.8863      0.00000
     24       3.0681      0.00000
     25       3.2221      0.00000
     26       3.3567      0.00000
     27       3.4299      0.00000
     28       3.8499      0.00000

 k-point    80 :       0.3750    0.3333    0.0000
  band No.  band energies     occupation 
      1     -24.1697      2.00000
      2     -22.5634      2.00000
      3     -22.5284      2.00000
      4     -21.0991      2.00000
      5     -16.4337      2.00000
      6     -15.0331      2.00000
      7     -14.5988      2.00000
      8     -12.9258      2.00000
      9     -11.6122      2.00000
     10     -11.3422      2.00000
     11     -10.7392      2.00000
     12      -9.7229      2.00000
     13      -9.6377      2.00000
     14      -9.1915      2.00000
     15      -8.7435      2.00000
     16      -8.5959      2.00000
     17      -5.2565      2.00000
     18      -5.1603      2.00000
     19      -5.0386      2.00000
     20      -4.5411      2.00000
     21       2.0899      0.00000
     22       2.0941      0.00000
     23       2.8690      0.00000
     24       3.3707      0.00000
     25       3.5595      0.00000
     26       3.7186      0.00000
     27       3.7479      0.00000
     28       3.9579      0.00000

 k-point    81 :       0.4375    0.3333    0.0000
  band No.  band energies     occupation 
      1     -23.8353      2.00000
      2     -23.0287      2.00000
      3     -22.2219      2.00000
      4     -21.5000      2.00000
      5     -16.1497      2.00000
      6     -15.4424      2.00000
      7     -14.1696      2.00000
      8     -13.3305      2.00000
      9     -11.0163      2.00000
     10     -11.0150      2.00000
     11     -10.6103      2.00000
     12      -9.9778      2.00000
     13      -9.5399      2.00000
     14      -9.0964      2.00000
     15      -8.9352      2.00000
     16      -8.8174      2.00000
     17      -5.2703      2.00000
     18      -5.2055      2.00000
     19      -5.1346      2.00000
     20      -4.7593      2.00000
     21       2.4474      0.00000
     22       2.4613      0.00000
     23       2.9584      0.00000
     24       3.2836      0.00000
     25       3.6093      0.00000
     26       3.8796      0.00000
     27       4.0430      0.00000
     28       4.0654      0.00000

 k-point    82 :       0.5000    0.3333    0.0000
  band No.  band energies     occupation 
      1     -23.4544      2.00000
      2     -23.4536      2.00000
      3     -21.8772      2.00000
      4     -21.8771      2.00000
      5     -15.8175      2.00000
      6     -15.8167      2.00000
      7     -13.7488      2.00000
      8     -13.7476      2.00000
      9     -10.7540      2.00000
     10     -10.7525      2.00000
     11     -10.4412      2.00000
     12     -10.4401      2.00000
     13      -9.2367      2.00000
     14      -9.2350      2.00000
     15      -8.9729      2.00000
     16      -8.9717      2.00000
     17      -5.2899      2.00000
     18      -5.2867      2.00000
     19      -4.9648      2.00000
     20      -4.9633      2.00000
     21       2.8113      0.00000
     22       2.8130      0.00000
     23       2.8765      0.00000
     24       2.8770      0.00000
     25       3.6409      0.00000
     26       3.6414      0.00000
     27       4.2077      0.00000
     28       4.2088      0.00000

 k-point    83 :      -0.4375    0.3333    0.0000
  band No.  band energies     occupation 
      1     -23.8353      2.00000
      2     -23.0287      2.00000
      3     -22.2219      2.00000
      4     -21.5001      2.00000
      5     -16.1494      2.00000
      6     -15.4428      2.00000
      7     -14.1695      2.00000
      8     -13.3307      2.00000
      9     -11.0166      2.00000
     10     -11.0151      2.00000
     11     -10.6098      2.00000
     12      -9.9774      2.00000
     13      -9.5386      2.00000
     14      -9.0960      2.00000
     15      -8.9363      2.00000
     16      -8.8182      2.00000
     17      -5.2684      2.00000
     18      -5.2073      2.00000
     19      -5.1359      2.00000
     20      -4.7581      2.00000
     21       2.4473      0.00000
     22       2.4612      0.00000
     23       2.9581      0.00000
     24       3.2838      0.00000
     25       3.6093      0.00000
     26       3.8796      0.00000
     27       4.0431      0.00000
     28       4.0653      0.00000

 k-point    84 :      -0.3750    0.3333    0.0000
  band No.  band energies     occupation 
      1     -24.1697      2.00000
      2     -22.5634      2.00000
      3     -22.5284      2.00000
      4     -21.0991      2.00000
      5     -16.4334      2.00000
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      8     -12.9262      2.00000
      9     -11.6121      2.00000
     10     -11.3429      2.00000
     11     -10.7379      2.00000
     12      -9.7220      2.00000
     13      -9.6370      2.00000
     14      -9.1917      2.00000
     15      -8.7443      2.00000
     16      -8.5966      2.00000
     17      -5.2579      2.00000
     18      -5.1585      2.00000
     19      -5.0401      2.00000
     20      -4.5399      2.00000
     21       2.0899      0.00000
     22       2.0939      0.00000
     23       2.8688      0.00000
     24       3.3707      0.00000
     25       3.5596      0.00000
     26       3.7182      0.00000
     27       3.7479      0.00000
     28       3.9576      0.00000

 k-point    85 :      -0.3125    0.3333    0.0000
  band No.  band energies     occupation 
      1     -24.4553      2.00000
      2     -22.7927      2.00000
      3     -22.0645      2.00000
      4     -20.6871      2.00000
      5     -16.6623      2.00000
      6     -15.0465      2.00000
      7     -14.5984      2.00000
      8     -12.6235      2.00000
      9     -12.0882      2.00000
     10     -11.7531      2.00000
     11     -11.0596      2.00000
     12      -9.6842      2.00000
     13      -9.5370      2.00000
     14      -9.2502      2.00000
     15      -8.6812      2.00000
     16      -8.3173      2.00000
     17      -5.3291      2.00000
     18      -4.9847      2.00000
     19      -4.8275      2.00000
     20      -4.3254      2.00000
     21       1.7814      0.00000
     22       1.7825      0.00000
     23       2.8861      0.00000
     24       3.0682      0.00000
     25       3.2222      0.00000
     26       3.3567      0.00000
     27       3.4288      0.00000
     28       3.8496      0.00000

 k-point    86 :      -0.2500    0.3333    0.0000
  band No.  band energies     occupation 
      1     -24.6906      2.00000
      2     -23.0120      2.00000
      3     -21.5423      2.00000
      4     -20.2832      2.00000
      5     -16.8291      2.00000
      6     -15.5232      2.00000
      7     -14.1500      2.00000
      8     -12.8512      2.00000
      9     -12.2589      2.00000
     10     -11.9787      2.00000
     11     -11.3589      2.00000
     12      -9.7506      2.00000
     13      -9.4237      2.00000
     14      -9.2968      2.00000
     15      -8.7126      2.00000
     16      -8.0535      2.00000
     17      -5.3584      2.00000
     18      -4.7807      2.00000
     19      -4.6172      2.00000
     20      -4.1242      2.00000
     21       1.5233      0.00000
     22       1.5399      0.00000
     23       2.7896      0.00000
     24       2.9681      0.00000
     25       2.9818      0.00000
     26       3.0468      0.00000
     27       3.1867      0.00000
     28       3.6004      0.00000

 k-point    87 :      -0.1875    0.3333    0.0000
  band No.  band energies     occupation 
      1     -24.8745      2.00000
      2     -23.1843      2.00000
      3     -21.0151      2.00000
      4     -19.9149      2.00000
      5     -16.9278      2.00000
      6     -16.0247      2.00000
      7     -13.7069      2.00000
      8     -13.2257      2.00000
      9     -12.7967      2.00000
     10     -11.6540      2.00000
     11     -11.5920      2.00000
     12      -9.8341      2.00000
     13      -9.4071      2.00000
     14      -9.3449      2.00000
     15      -8.7590      2.00000
     16      -7.8550      2.00000
     17      -5.3556      2.00000
     18      -4.5832      2.00000
     19      -4.4415      2.00000
     20      -3.9457      2.00000
     21       1.3234      0.00000
     22       1.3585      0.00000
     23       2.5568      0.00000
     24       2.7767      0.00000
     25       2.8023      0.00000
     26       3.0452      0.00000
     27       3.0644      0.00000
     28       3.3823      0.00000

 k-point    88 :      -0.1250    0.3333    0.0000
  band No.  band energies     occupation 
      1     -25.0064      2.00000
      2     -23.3083      2.00000
      3     -20.5191      2.00000
      4     -19.6171      2.00000
      5     -16.9598      2.00000
      6     -16.5153      2.00000
      7     -13.5043      2.00000
      8     -13.3058      2.00000
      9     -13.2733      2.00000
     10     -11.7768      2.00000
     11     -11.3713      2.00000
     12      -9.9010      2.00000
     13      -9.5104      2.00000
     14      -9.3878      2.00000
     15      -8.7611      2.00000
     16      -7.7344      2.00000
     17      -5.3326      2.00000
     18      -4.4297      2.00000
     19      -4.3058      2.00000
     20      -3.8031      2.00000
     21       1.1841      0.00000
     22       1.2297      0.00000
     23       2.3837      0.00000
     24       2.5979      0.00000
     25       2.6750      0.00000
     26       2.9498      0.00000
     27       3.0502      0.00000
     28       3.2393      0.00000

 k-point    89 :      -0.0625    0.3333    0.0000
  band No.  band energies     occupation 
      1     -25.0857      2.00000
      2     -23.3830      2.00000
      3     -20.1287      2.00000
      4     -19.4242      2.00000
      5     -16.9471      2.00000
      6     -16.9101      2.00000
      7     -13.6693      2.00000
      8     -13.6255      2.00000
      9     -12.9785      2.00000
     10     -11.9209      2.00000
     11     -11.1823      2.00000
     12      -9.9407      2.00000
     13      -9.6428      2.00000
     14      -9.4169      2.00000
     15      -8.7424      2.00000
     16      -7.6784      2.00000
     17      -5.3066      2.00000
     18      -4.3427      2.00000
     19      -4.2106      2.00000
     20      -3.7105      2.00000
     21       1.1030      0.00000
     22       1.1515      0.00000
     23       2.2783      0.00000
     24       2.4902      0.00000
     25       2.5926      0.00000
     26       2.8310      0.00000
     27       3.0354      0.00000
     28       3.1919      0.00000

 k-point    90 :       0.0000    0.4000    0.0000
  band No.  band energies     occupation 
      1     -24.8514      2.00000
      2     -23.8219      2.00000
      3     -19.7954      2.00000
      4     -19.3557      2.00000
      5     -17.0371      2.00000
      6     -17.0172      2.00000
      7     -13.9226      2.00000
      8     -13.9145      2.00000
      9     -12.4074      2.00000
     10     -11.5609      2.00000
     11     -11.3365      2.00000
     12     -10.2364      2.00000
     13      -9.5581      2.00000
     14      -9.5125      2.00000
     15      -8.4760      2.00000
     16      -7.7724      2.00000
     17      -5.2064      2.00000
     18      -4.5492      2.00000
     19      -4.1914      2.00000
     20      -3.8539      2.00000
     21       1.3578      0.00000
     22       1.4279      0.00000
     23       2.5254      0.00000
     24       2.6758      0.00000
     25       2.6867      0.00000
     26       2.8600      0.00000
     27       3.1149      0.00000
     28       3.3992      0.00000

 k-point    91 :       0.0625    0.4000    0.0000
  band No.  band energies     occupation 
      1     -24.8251      2.00000
      2     -23.7965      2.00000
      3     -19.9468      2.00000
      4     -19.4546      2.00000
      5     -16.9850      2.00000
      6     -16.8980      2.00000
      7     -13.8453      2.00000
      8     -13.8041      2.00000
      9     -12.5386      2.00000
     10     -11.4974      2.00000
     11     -11.4290      2.00000
     12     -10.2010      2.00000
     13      -9.5173      2.00000
     14      -9.4970      2.00000
     15      -8.4725      2.00000
     16      -7.7780      2.00000
     17      -5.2253      2.00000
     18      -4.5802      2.00000
     19      -4.2223      2.00000
     20      -3.8869      2.00000
     21       1.3855      0.00000
     22       1.4545      0.00000
     23       2.5524      0.00000
     24       2.7107      0.00000
     25       2.7195      0.00000
     26       2.8940      0.00000
     27       3.1307      0.00000
     28       3.4008      0.00000

 k-point    92 :       0.1250    0.4000    0.0000
  band No.  band energies     occupation 
      1     -24.7463      2.00000
      2     -23.7203      2.00000
      3     -20.3235      2.00000
      4     -19.7225      2.00000
      5     -16.8940      2.00000
      6     -16.5611      2.00000
      7     -13.6370      2.00000
      8     -13.4755      2.00000
      9     -12.8520      2.00000
     10     -11.6727      2.00000
     11     -11.3610      2.00000
     12     -10.1154      2.00000
     13      -9.4537      2.00000
     14      -9.4245      2.00000
     15      -8.4644      2.00000
     16      -7.8093      2.00000
     17      -5.2744      2.00000
     18      -4.6713      2.00000
     19      -4.3095      2.00000
     20      -3.9813      2.00000
     21       1.4696      0.00000
     22       1.5329      0.00000
     23       2.6305      0.00000
     24       2.7985      0.00000
     25       2.8172      0.00000
     26       2.9944      0.00000
     27       3.1435      0.00000
     28       3.3941      0.00000

 k-point    93 :       0.1875    0.4000    0.0000
  band No.  band energies     occupation 
      1     -24.6153      2.00000
      2     -23.5939      2.00000
      3     -20.8059      2.00000
      4     -20.1000      2.00000
      5     -16.7533      2.00000
      6     -16.1508      2.00000
      7     -13.2945      2.00000
      8     -13.2739      2.00000
      9     -12.9720      2.00000
     10     -12.0061      2.00000
     11     -11.1973      2.00000
     12     -10.0088      2.00000
     13      -9.3891      2.00000
     14      -9.3415      2.00000
     15      -8.4612      2.00000
     16      -7.8979      2.00000
     17      -5.3351      2.00000
     18      -4.8146      2.00000
     19      -4.4424      2.00000
     20      -4.1257      2.00000
     21       1.6128      0.00000
     22       1.6596      0.00000
     23       2.7450      0.00000
     24       2.8760      0.00000
     25       2.9673      0.00000
     26       3.1335      0.00000
     27       3.1612      0.00000
     28       3.4969      0.00000

 k-point    94 :       0.2500    0.4000    0.0000
  band No.  band energies     occupation 
      1     -24.4327      2.00000
      2     -23.4179      2.00000
      3     -21.3217      2.00000
      4     -20.5330      2.00000
      5     -16.5674      2.00000
      6     -15.7355      2.00000
      7     -13.7054      2.00000
      8     -12.8715      2.00000
      9     -12.4056      2.00000
     10     -12.3454      2.00000
     11     -11.0111      2.00000
     12      -9.8994      2.00000
     13      -9.3186      2.00000
     14      -9.3127      2.00000
     15      -8.4815      2.00000
     16      -8.0687      2.00000
     17      -5.3872      2.00000
     18      -4.9904      2.00000
     19      -4.6154      2.00000
     20      -4.3059      2.00000
     21       1.8158      0.00000
     22       1.8329      0.00000
     23       2.8570      0.00000
     24       2.8662      0.00000
     25       3.1262      0.00000
     26       3.2897      0.00000
     27       3.4020      0.00000
     28       3.6980      0.00000

 k-point    95 :       0.3125    0.4000    0.0000
  band No.  band energies     occupation 
      1     -24.1992      2.00000
      2     -23.1934      2.00000
      3     -21.8347      2.00000
      4     -20.9841      2.00000
      5     -16.3376      2.00000
      6     -15.3343      2.00000
      7     -14.1532      2.00000
      8     -12.9163      2.00000
      9     -12.1450      2.00000
     10     -11.8029      2.00000
     11     -10.8017      2.00000
     12      -9.8094      2.00000
     13      -9.3671      2.00000
     14      -9.2360      2.00000
     15      -8.5544      2.00000
     16      -8.3227      2.00000
     17      -5.4123      2.00000
     18      -5.1670      2.00000
     19      -4.8224      2.00000
     20      -4.5106      2.00000
     21       2.0600      0.00000
     22       2.0750      0.00000
     23       2.8158      0.00000
     24       3.0355      0.00000
     25       3.3488      0.00000
     26       3.5902      0.00000
     27       3.7118      0.00000
     28       3.8637      0.00000

 k-point    96 :       0.3750    0.4000    0.0000
  band No.  band energies     occupation 
      1     -23.9159      2.00000
      2     -22.9221      2.00000
      3     -22.3264      2.00000
      4     -21.4296      2.00000
      5     -16.0649      2.00000
      6     -14.9423      2.00000
      7     -14.5919      2.00000
      8     -13.3156      2.00000
      9     -11.5438      2.00000
     10     -11.2383      2.00000
     11     -10.5827      2.00000
     12      -9.7905      2.00000
     13      -9.4508      2.00000
     14      -9.1671      2.00000
     15      -8.7113      2.00000
     16      -8.6228      2.00000
     17      -5.3905      2.00000
     18      -5.3071      2.00000
     19      -5.0407      2.00000
     20      -4.7313      2.00000
     21       2.3542      0.00000
     22       2.3819      0.00000
     23       2.8954      0.00000
     24       3.3034      0.00000
     25       3.5904      0.00000
     26       3.9456      0.00000
     27       3.9467      0.00000
     28       4.1344      0.00000

 k-point    97 :       0.4375    0.4000    0.0000
  band No.  band energies     occupation 
      1     -23.5843      2.00000
      2     -22.7859      2.00000
      3     -22.6062      2.00000
      4     -21.8544      2.00000
      5     -15.7508      2.00000
      6     -15.0094      2.00000
      7     -14.5492      2.00000
      8     -13.7345      2.00000
      9     -10.9177      2.00000
     10     -10.7870      2.00000
     11     -10.4327      2.00000
     12      -9.9489      2.00000
     13      -9.4574      2.00000
     14      -9.1030      2.00000
     15      -8.9619      2.00000
     16      -8.8772      2.00000
     17      -5.3759      2.00000
     18      -5.3048      2.00000
     19      -5.2300      2.00000
     20      -4.9540      2.00000
     21       2.7154      0.00000
     22       2.7306      0.00000
     23       3.1097      0.00000
     24       3.4483      0.00000
     25       3.7527      0.00000
     26       3.7623      0.00000
     27       4.1600      0.00000
     28       4.1643      0.00000

 k-point    98 :       0.5000    0.4000    0.0000
  band No.  band energies     occupation 
      1     -23.2070      2.00000
      2     -23.2063      2.00000
      3     -22.2490      2.00000
      4     -22.2486      2.00000
      5     -15.3978      2.00000
      6     -15.3974      2.00000
      7     -14.1478      2.00000
      8     -14.1469      2.00000
      9     -10.5023      2.00000
     10     -10.5008      2.00000
     11     -10.3529      2.00000
     12     -10.3517      2.00000
     13      -9.2601      2.00000
     14      -9.2583      2.00000
     15      -9.0220      2.00000
     16      -9.0208      2.00000
     17      -5.3515      2.00000
     18      -5.3488      2.00000
     19      -5.1546      2.00000
     20      -5.1532      2.00000
     21       3.0877      0.00000
     22       3.0898      0.00000
     23       3.1147      0.00000
     24       3.1151      0.00000
     25       3.7527      0.00000
     26       3.7531      0.00000
     27       4.0836      0.00000
     28       4.0860      0.00000

 k-point    99 :      -0.4375    0.4000    0.0000
  band No.  band energies     occupation 
      1     -23.5843      2.00000
      2     -22.7859      2.00000
      3     -22.6062      2.00000
      4     -21.8544      2.00000
      5     -15.7505      2.00000
      6     -15.0097      2.00000
      7     -14.5491      2.00000
      8     -13.7346      2.00000
      9     -10.9176      2.00000
     10     -10.7881      2.00000
     11     -10.4312      2.00000
     12      -9.9489      2.00000
     13      -9.4567      2.00000
     14      -9.1022      2.00000
     15      -8.9627      2.00000
     16      -8.8780      2.00000
     17      -5.3743      2.00000
     18      -5.3063      2.00000
     19      -5.2315      2.00000
     20      -4.9526      2.00000
     21       2.7154      0.00000
     22       2.7306      0.00000
     23       3.1094      0.00000
     24       3.4484      0.00000
     25       3.7523      0.00000
     26       3.7622      0.00000
     27       4.1603      0.00000
     28       4.1642      0.00000

 k-point   100 :      -0.3750    0.4000    0.0000
  band No.  band energies     occupation 
      1     -23.9159      2.00000
      2     -22.9221      2.00000
      3     -22.3264      2.00000
      4     -21.4296      2.00000
      5     -16.0647      2.00000
      6     -14.9423      2.00000
      7     -14.5923      2.00000
      8     -13.3157      2.00000
      9     -11.5437      2.00000
     10     -11.2393      2.00000
     11     -10.5809      2.00000
     12      -9.7905      2.00000
     13      -9.4507      2.00000
     14      -9.1668      2.00000
     15      -8.7118      2.00000
     16      -8.6234      2.00000
     17      -5.3921      2.00000
     18      -5.3055      2.00000
     19      -5.0420      2.00000
     20      -4.7301      2.00000
     21       2.3543      0.00000
     22       2.3817      0.00000
     23       2.8951      0.00000
     24       3.3033      0.00000
     25       3.5898      0.00000
     26       3.9458      0.00000
     27       3.9467      0.00000
     28       4.1343      0.00000

 k-point   101 :      -0.3125    0.4000    0.0000
  band No.  band energies     occupation 
      1     -24.1992      2.00000
      2     -23.1934      2.00000
      3     -21.8347      2.00000
      4     -20.9841      2.00000
      5     -16.3374      2.00000
      6     -15.3343      2.00000
      7     -14.1536      2.00000
      8     -12.9166      2.00000
      9     -12.1448      2.00000
     10     -11.8036      2.00000
     11     -10.7999      2.00000
     12      -9.8093      2.00000
     13      -9.3674      2.00000
     14      -9.2360      2.00000
     15      -8.5546      2.00000
     16      -8.3231      2.00000
     17      -5.4138      2.00000
     18      -5.1655      2.00000
     19      -4.8236      2.00000
     20      -4.5095      2.00000
     21       2.0601      0.00000
     22       2.0747      0.00000
     23       2.8156      0.00000
     24       3.0356      0.00000
     25       3.3480      0.00000
     26       3.5902      0.00000
     27       3.7119      0.00000
     28       3.8632      0.00000

 k-point   102 :      -0.2500    0.4000    0.0000
  band No.  band energies     occupation 
      1     -24.4327      2.00000
      2     -23.4178      2.00000
      3     -21.3216      2.00000
      4     -20.5330      2.00000
      5     -16.5672      2.00000
      6     -15.7355      2.00000
      7     -13.7059      2.00000
      8     -12.8719      2.00000
      9     -12.4061      2.00000
     10     -12.3451      2.00000
     11     -11.0094      2.00000
     12      -9.8991      2.00000
     13      -9.3192      2.00000
     14      -9.3128      2.00000
     15      -8.4814      2.00000
     16      -8.0690      2.00000
     17      -5.3887      2.00000
     18      -4.9891      2.00000
     19      -4.6164      2.00000
     20      -4.3049      2.00000
     21       1.8154      0.00000
     22       1.8330      0.00000
     23       2.8567      0.00000
     24       2.8666      0.00000
     25       3.1255      0.00000
     26       3.2895      0.00000
     27       3.4020      0.00000
     28       3.6984      0.00000

 k-point   103 :      -0.1875    0.4000    0.0000
  band No.  band energies     occupation 
      1     -24.6154      2.00000
      2     -23.5939      2.00000
      3     -20.8059      2.00000
      4     -20.1000      2.00000
      5     -16.7531      2.00000
      6     -16.1508      2.00000
      7     -13.2946      2.00000
      8     -13.2744      2.00000
      9     -12.9725      2.00000
     10     -12.0060      2.00000
     11     -11.1956      2.00000
     12     -10.0085      2.00000
     13      -9.3894      2.00000
     14      -9.3424      2.00000
     15      -8.4609      2.00000
     16      -7.8981      2.00000
     17      -5.3363      2.00000
     18      -4.8135      2.00000
     19      -4.4431      2.00000
     20      -4.1249      2.00000
     21       1.6125      0.00000
     22       1.6596      0.00000
     23       2.7453      0.00000
     24       2.8757      0.00000
     25       2.9672      0.00000
     26       3.1329      0.00000
     27       3.1612      0.00000
     28       3.4973      0.00000

 k-point   104 :      -0.1250    0.4000    0.0000
  band No.  band energies     occupation 
      1     -24.7463      2.00000
      2     -23.7203      2.00000
      3     -20.3235      2.00000
      4     -19.7226      2.00000
      5     -16.8939      2.00000
      6     -16.5611      2.00000
      7     -13.6371      2.00000
      8     -13.4757      2.00000
      9     -12.8529      2.00000
     10     -11.6727      2.00000
     11     -11.3594      2.00000
     12     -10.1151      2.00000
     13      -9.4540      2.00000
     14      -9.4253      2.00000
     15      -8.4640      2.00000
     16      -7.8094      2.00000
     17      -5.2753      2.00000
     18      -4.6706      2.00000
     19      -4.3100      2.00000
     20      -3.9808      2.00000
     21       1.4694      0.00000
     22       1.5329      0.00000
     23       2.6307      0.00000
     24       2.7984      0.00000
     25       2.8173      0.00000
     26       2.9944      0.00000
     27       3.1432      0.00000
     28       3.3942      0.00000

 k-point   105 :      -0.0625    0.4000    0.0000
  band No.  band energies     occupation 
      1     -24.8251      2.00000
      2     -23.7965      2.00000
      3     -19.9468      2.00000
      4     -19.4546      2.00000
      5     -16.9849      2.00000
      6     -16.8980      2.00000
      7     -13.8453      2.00000
      8     -13.8042      2.00000
      9     -12.5393      2.00000
     10     -11.4963      2.00000
     11     -11.4290      2.00000
     12     -10.2008      2.00000
     13      -9.5179      2.00000
     14      -9.4972      2.00000
     15      -8.4722      2.00000
     16      -7.7780      2.00000
     17      -5.2257      2.00000
     18      -4.5799      2.00000
     19      -4.2225      2.00000
     20      -3.8866      2.00000
     21       1.3854      0.00000
     22       1.4545      0.00000
     23       2.5525      0.00000
     24       2.7107      0.00000
     25       2.7195      0.00000
     26       2.8940      0.00000
     27       3.1307      0.00000
     28       3.4005      0.00000

 k-point   106 :       0.0000    0.4667    0.0000
  band No.  band energies     occupation 
      1     -24.5476      2.00000
      2     -24.2032      2.00000
      3     -19.6156      2.00000
      4     -19.4563      2.00000
      5     -17.0320      2.00000
      6     -17.0271      2.00000
      7     -14.0182      2.00000
      8     -14.0166      2.00000
      9     -11.9998      2.00000
     10     -11.6373      2.00000
     11     -11.1033      2.00000
     12     -10.6469      2.00000
     13      -9.5106      2.00000
     14      -9.5063      2.00000
     15      -8.2032      2.00000
     16      -7.9573      2.00000
     17      -5.0363      2.00000
     18      -4.8055      2.00000
     19      -4.1325      2.00000
     20      -4.0132      2.00000
     21       1.6613      0.00000
     22       1.7332      0.00000
     23       2.2928      0.00000
     24       2.3999      0.00000
     25       3.1163      0.00000
     26       3.2988      0.00000
     27       3.4271      0.00000
     28       3.5598      0.00000

 k-point   107 :       0.0625    0.4667    0.0000
  band No.  band energies     occupation 
      1     -24.5215      2.00000
      2     -24.1775      2.00000
      3     -19.7565      2.00000
      4     -19.5805      2.00000
      5     -16.9576      2.00000
      6     -16.9170      2.00000
      7     -13.9302      2.00000
      8     -13.9137      2.00000
      9     -12.1246      2.00000
     10     -11.7497      2.00000
     11     -11.0434      2.00000
     12     -10.5954      2.00000
     13      -9.4887      2.00000
     14      -9.4777      2.00000
     15      -8.1962      2.00000
     16      -7.9546      2.00000
     17      -5.0615      2.00000
     18      -4.8351      2.00000
     19      -4.1639      2.00000
     20      -4.0460      2.00000
     21       1.6902      0.00000
     22       1.7617      0.00000
     23       2.3166      0.00000
     24       2.4260      0.00000
     25       3.1507      0.00000
     26       3.3324      0.00000
     27       3.4212      0.00000
     28       3.5705      0.00000

 k-point   108 :       0.1250    0.4667    0.0000
  band No.  band energies     occupation 
      1     -24.4434      2.00000
      2     -24.1002      2.00000
      3     -20.1120      2.00000
      4     -19.9019      2.00000
      5     -16.7739      2.00000
      6     -16.6514      2.00000
      7     -13.6748      2.00000
      8     -13.6158      2.00000
      9     -12.4271      2.00000
     10     -12.0303      2.00000
     11     -10.9144      2.00000
     12     -10.4812      2.00000
     13      -9.4322      2.00000
     14      -9.4071      2.00000
     15      -8.1870      2.00000
     16      -7.9616      2.00000
     17      -5.1306      2.00000
     18      -4.9187      2.00000
     19      -4.2535      2.00000
     20      -4.1391      2.00000
     21       1.7774      0.00000
     22       1.8461      0.00000
     23       2.3861      0.00000
     24       2.4965      0.00000
     25       3.2412      0.00000
     26       3.3550      0.00000
     27       3.4146      0.00000
     28       3.5160      0.00000

 k-point   109 :       0.1875    0.4667    0.0000
  band No.  band energies     occupation 
      1     -24.3135      2.00000
      2     -23.9719      2.00000
      3     -20.5737      2.00000
      4     -20.3313      2.00000
      5     -16.5394      2.00000
      6     -16.3283      2.00000
      7     -13.2737      2.00000
      8     -13.1787      2.00000
      9     -12.7987      2.00000
     10     -12.3936      2.00000
     11     -10.7638      2.00000
     12     -10.3476      2.00000
     13      -9.3577      2.00000
     14      -9.3290      2.00000
     15      -8.2055      2.00000
     16      -8.0136      2.00000
     17      -5.2267      2.00000
     18      -5.0429      2.00000
     19      -4.3902      2.00000
     20      -4.2809      2.00000
     21       1.9244      0.00000
     22       1.9817      0.00000
     23       2.4916      0.00000
     24       2.5836      0.00000
     25       3.1966      0.00000
     26       3.3524      0.00000
     27       3.4553      0.00000
     28       3.6343      0.00000

 k-point   110 :       0.2500    0.4667    0.0000
  band No.  band energies     occupation 
      1     -24.1326      2.00000
      2     -23.7930      2.00000
      3     -21.0727      2.00000
      4     -20.8046      2.00000
      5     -16.2792      2.00000
      6     -15.9940      2.00000
      7     -13.2819      2.00000
      8     -12.9423      2.00000
      9     -12.6089      2.00000
     10     -12.5600      2.00000
     11     -10.6018      2.00000
     12     -10.2096      2.00000
     13      -9.2829      2.00000
     14      -9.2730      2.00000
     15      -8.2850      2.00000
     16      -8.1436      2.00000
     17      -5.3286      2.00000
     18      -5.1874      2.00000
     19      -4.5647      2.00000
     20      -4.4591      2.00000
     21       2.1304      0.00000
     22       2.1593      0.00000
     23       2.6192      0.00000
     24       2.6422      0.00000
     25       3.1795      0.00000
     26       3.3301      0.00000
     27       3.7016      0.00000
     28       3.8792      0.00000

 k-point   111 :       0.3125    0.4667    0.0000
  band No.  band energies     occupation 
      1     -23.9013      2.00000
      2     -23.5647      2.00000
      3     -21.5727      2.00000
      4     -21.2854      2.00000
      5     -15.9961      2.00000
      6     -15.6563      2.00000
      7     -13.7183      2.00000
      8     -13.3002      2.00000
      9     -12.0729      2.00000
     10     -11.9425      2.00000
     11     -10.4344      2.00000
     12     -10.0797      2.00000
     13      -9.2576      2.00000
     14      -9.2224      2.00000
     15      -8.4457      2.00000
     16      -8.3644      2.00000
     17      -5.4121      2.00000
     18      -5.3238      2.00000
     19      -4.7706      2.00000
     20      -4.6649      2.00000
     21       2.3746      0.00000
     22       2.3897      0.00000
     23       2.7041      0.00000
     24       2.7920      0.00000
     25       3.3203      0.00000
     26       3.4696      0.00000
     27       4.0193      0.00000
     28       4.1975      0.00000

 k-point   112 :       0.3750    0.4667    0.0000
  band No.  band energies     occupation 
      1     -23.6210      2.00000
      2     -23.2883      2.00000
      3     -22.0542      2.00000
      4     -21.7524      2.00000
      5     -15.6862      2.00000
      6     -15.3086      2.00000
      7     -14.1563      2.00000
      8     -13.7293      2.00000
      9     -11.4351      2.00000
     10     -11.3143      2.00000
     11     -10.2821      2.00000
     12      -9.9894      2.00000
     13      -9.2821      2.00000
     14      -9.1870      2.00000
     15      -8.6872      2.00000
     16      -8.6570      2.00000
     17      -5.4478      2.00000
     18      -5.4165      2.00000
     19      -4.9930      2.00000
     20      -4.8883      2.00000
     21       2.6494      0.00000
     22       2.6899      0.00000
     23       2.8826      0.00000
     24       3.0545      0.00000
     25       3.5456      0.00000
     26       3.6800      0.00000
     27       4.3599      0.00000
     28       4.5699      0.00000

 k-point   113 :       0.4375    0.4667    0.0000
  band No.  band energies     occupation 
      1     -23.2932      2.00000
      2     -22.9656      2.00000
      3     -22.5058      2.00000
      4     -22.1931      2.00000
      5     -15.3467      2.00000
      6     -14.9441      2.00000
      7     -14.5785      2.00000
      8     -14.1525      2.00000
      9     -10.8178      2.00000
     10     -10.7476      2.00000
     11     -10.2080      2.00000
     12     -10.0225      2.00000
     13      -9.3043      2.00000
     14      -9.1691      2.00000
     15      -8.9756      2.00000
     16      -8.9472      2.00000
     17      -5.4335      2.00000
     18      -5.4101      2.00000
     19      -5.2014      2.00000
     20      -5.1082      2.00000
     21       3.0039      0.00000
     22       3.0378      0.00000
     23       3.1924      0.00000
     24       3.3910      0.00000
     25       3.6620      0.00000
     26       3.7650      0.00000
     27       4.1727      0.00000
     28       4.1895      0.00000

 k-point   114 :       0.5000    0.4667    0.0000
  band No.  band energies     occupation 
      1     -22.9207      2.00000
      2     -22.9201      2.00000
      3     -22.5995      2.00000
      4     -22.5990      2.00000
      5     -14.9770      2.00000
      6     -14.9767      2.00000
      7     -14.5591      2.00000
      8     -14.5585      2.00000
      9     -10.3453      2.00000
     10     -10.3437      2.00000
     11     -10.3070      2.00000
     12     -10.3056      2.00000
     13      -9.2173      2.00000
     14      -9.2156      2.00000
     15      -9.1183      2.00000
     16      -9.1170      2.00000
     17      -5.3596      2.00000
     18      -5.3574      2.00000
     19      -5.2929      2.00000
     20      -5.2912      2.00000
     21       3.3783      0.00000
     22       3.3803      0.00000
     23       3.3892      0.00000
     24       3.3898      0.00000
     25       3.7310      0.00000
     26       3.7317      0.00000
     27       3.8105      0.00000
     28       3.8130      0.00000

 k-point   115 :      -0.4375    0.4667    0.0000
  band No.  band energies     occupation 
      1     -23.2932      2.00000
      2     -22.9656      2.00000
      3     -22.5058      2.00000
      4     -22.1931      2.00000
      5     -15.3466      2.00000
      6     -14.9442      2.00000
      7     -14.5787      2.00000
      8     -14.1524      2.00000
      9     -10.8174      2.00000
     10     -10.7484      2.00000
     11     -10.2066      2.00000
     12     -10.0233      2.00000
     13      -9.3044      2.00000
     14      -9.1683      2.00000
     15      -8.9759      2.00000
     16      -8.9478      2.00000
     17      -5.4319      2.00000
     18      -5.4116      2.00000
     19      -5.2029      2.00000
     20      -5.1068      2.00000
     21       3.0042      0.00000
     22       3.0377      0.00000
     23       3.1922      0.00000
     24       3.3904      0.00000
     25       3.6622      0.00000
     26       3.7649      0.00000
     27       4.1728      0.00000
     28       4.1897      0.00000

 k-point   116 :      -0.3750    0.4667    0.0000
  band No.  band energies     occupation 
      1     -23.6210      2.00000
      2     -23.2883      2.00000
      3     -22.0542      2.00000
      4     -21.7524      2.00000
      5     -15.6861      2.00000
      6     -15.3087      2.00000
      7     -14.1565      2.00000
      8     -13.7292      2.00000
      9     -11.4348      2.00000
     10     -11.3148      2.00000
     11     -10.2807      2.00000
     12      -9.9902      2.00000
     13      -9.2825      2.00000
     14      -9.1864      2.00000
     15      -8.6873      2.00000
     16      -8.6574      2.00000
     17      -5.4494      2.00000
     18      -5.4149      2.00000
     19      -4.9943      2.00000
     20      -4.8870      2.00000
     21       2.6498      0.00000
     22       2.6896      0.00000
     23       2.8825      0.00000
     24       3.0541      0.00000
     25       3.5458      0.00000
     26       3.6800      0.00000
     27       4.3601      0.00000
     28       4.5665      0.00000

 k-point   117 :      -0.3125    0.4667    0.0000
  band No.  band energies     occupation 
      1     -23.9013      2.00000
      2     -23.5647      2.00000
      3     -21.5726      2.00000
      4     -21.2854      2.00000
      5     -15.9959      2.00000
      6     -15.6563      2.00000
      7     -13.7186      2.00000
      8     -13.3002      2.00000
      9     -12.0727      2.00000
     10     -11.9429      2.00000
     11     -10.4331      2.00000
     12     -10.0805      2.00000
     13      -9.2581      2.00000
     14      -9.2219      2.00000
     15      -8.4456      2.00000
     16      -8.3647      2.00000
     17      -5.4136      2.00000
     18      -5.3222      2.00000
     19      -4.7717      2.00000
     20      -4.6638      2.00000
     21       2.3749      0.00000
     22       2.3893      0.00000
     23       2.7039      0.00000
     24       2.7919      0.00000
     25       3.3203      0.00000
     26       3.4697      0.00000
     27       4.0193      0.00000
     28       4.1975      0.00000

 k-point   118 :      -0.2500    0.4667    0.0000
  band No.  band energies     occupation 
      1     -24.1326      2.00000
      2     -23.7930      2.00000
      3     -21.0726      2.00000
      4     -20.8047      2.00000
      5     -16.2791      2.00000
      6     -15.9941      2.00000
      7     -13.2822      2.00000
      8     -12.9426      2.00000
      9     -12.6084      2.00000
     10     -12.5603      2.00000
     11     -10.6005      2.00000
     12     -10.2104      2.00000
     13      -9.2825      2.00000
     14      -9.2736      2.00000
     15      -8.2848      2.00000
     16      -8.1439      2.00000
     17      -5.3301      2.00000
     18      -5.1861      2.00000
     19      -4.5657      2.00000
     20      -4.4581      2.00000
     21       2.1301      0.00000
     22       2.1595      0.00000
     23       2.6194      0.00000
     24       2.6420      0.00000
     25       3.1794      0.00000
     26       3.3302      0.00000
     27       3.7016      0.00000
     28       3.8792      0.00000

 k-point   119 :      -0.1875    0.4667    0.0000
  band No.  band energies     occupation 
      1     -24.3135      2.00000
      2     -23.9718      2.00000
      3     -20.5737      2.00000
      4     -20.3313      2.00000
      5     -16.5393      2.00000
      6     -16.3283      2.00000
      7     -13.2738      2.00000
      8     -13.1786      2.00000
      9     -12.7993      2.00000
     10     -12.3932      2.00000
     11     -10.7625      2.00000
     12     -10.3483      2.00000
     13      -9.3574      2.00000
     14      -9.3297      2.00000
     15      -8.2052      2.00000
     16      -8.0138      2.00000
     17      -5.2279      2.00000
     18      -5.0417      2.00000
     19      -4.3909      2.00000
     20      -4.2802      2.00000
     21       1.9241      0.00000
     22       1.9818      0.00000
     23       2.4920      0.00000
     24       2.5834      0.00000
     25       3.1965      0.00000
     26       3.3523      0.00000
     27       3.4553      0.00000
     28       3.6343      0.00000

 k-point   120 :      -0.1250    0.4667    0.0000
  band No.  band energies     occupation 
      1     -24.4434      2.00000
      2     -24.1002      2.00000
      3     -20.1120      2.00000
      4     -19.9020      2.00000
      5     -16.7738      2.00000
      6     -16.6515      2.00000
      7     -13.6748      2.00000
      8     -13.6159      2.00000
      9     -12.4277      2.00000
     10     -12.0300      2.00000
     11     -10.9132      2.00000
     12     -10.4818      2.00000
     13      -9.4319      2.00000
     14      -9.4077      2.00000
     15      -8.1867      2.00000
     16      -7.9617      2.00000
     17      -5.1315      2.00000
     18      -4.9179      2.00000
     19      -4.2540      2.00000
     20      -4.1386      2.00000
     21       1.7772      0.00000
     22       1.8462      0.00000
     23       2.3864      0.00000
     24       2.4963      0.00000
     25       3.2412      0.00000
     26       3.3549      0.00000
     27       3.4145      0.00000
     28       3.5161      0.00000

 k-point   121 :      -0.0625    0.4667    0.0000
  band No.  band energies     occupation 
      1     -24.5215      2.00000
      2     -24.1775      2.00000
      3     -19.7565      2.00000
      4     -19.5805      2.00000
      5     -16.9576      2.00000
      6     -16.9170      2.00000
      7     -13.9302      2.00000
      8     -13.9137      2.00000
      9     -12.1251      2.00000
     10     -11.7495      2.00000
     11     -11.0426      2.00000
     12     -10.5958      2.00000
     13      -9.4886      2.00000
     14      -9.4780      2.00000
     15      -8.1961      2.00000
     16      -7.9547      2.00000
     17      -5.0620      2.00000
     18      -4.8347      2.00000
     19      -4.1642      2.00000
     20      -4.0457      2.00000
     21       1.6901      0.00000
     22       1.7618      0.00000
     23       2.3168      0.00000
     24       2.4259      0.00000
     25       3.1507      0.00000
     26       3.3324      0.00000
     27       3.4208      0.00000
     28       3.5708      0.00000

 k-point   122 :       0.0000    0.0000    0.3333
  band No.  band energies     occupation 
      1     -25.7165      2.00000
      2     -21.3816      2.00000
      3     -20.6296      2.00000
      4     -20.4253      2.00000
      5     -17.2649      2.00000
      6     -15.5161      2.00000
      7     -14.8875      2.00000
      8     -13.4850      2.00000
      9     -12.6372      2.00000
     10     -12.2239      2.00000
     11     -11.0312      2.00000
     12     -11.0289      2.00000
     13      -9.9204      2.00000
     14      -9.3140      2.00000
     15      -8.4783      2.00000
     16      -7.6971      2.00000
     17      -5.1007      2.00000
     18      -4.0455      2.00000
     19      -3.7240      2.00000
     20      -3.1672      2.00000
     21       0.4817      0.00000
     22       0.5560      0.00000
     23       1.3699      0.00000
     24       1.6015      0.00000
     25       1.9428      0.00000
     26       2.4032      0.00000
     27       2.4707      0.00000
     28       2.6970      0.00000

 k-point   123 :       0.0625    0.0000    0.3333
  band No.  band energies     occupation 
      1     -25.6896      2.00000
      2     -21.3618      2.00000
      3     -20.6163      2.00000
      4     -20.5933      2.00000
      5     -17.0678      2.00000
      6     -15.6314      2.00000
      7     -15.0145      2.00000
      8     -13.4199      2.00000
      9     -12.6149      2.00000
     10     -12.0874      2.00000
     11     -11.0068      2.00000
     12     -10.9290      2.00000
     13      -9.9380      2.00000
     14      -9.3619      2.00000
     15      -8.5301      2.00000
     16      -7.7372      2.00000
     17      -5.0864      2.00000
     18      -4.0701      2.00000
     19      -3.7708      2.00000
     20      -3.1910      2.00000
     21       0.5042      0.00000
     22       0.5859      0.00000
     23       1.4061      0.00000
     24       1.6367      0.00000
     25       1.9765      0.00000
     26       2.4355      0.00000
     27       2.5520      0.00000
     28       2.7841      0.00000

 k-point   124 :       0.1250    0.0000    0.3333
  band No.  band energies     occupation 
      1     -25.6093      2.00000
      2     -21.3032      2.00000
      3     -21.0054      2.00000
      4     -20.5781      2.00000
      5     -16.5701      2.00000
      6     -15.9230      2.00000
      7     -15.3267      2.00000
      8     -13.2681      2.00000
      9     -12.5490      2.00000
     10     -11.7366      2.00000
     11     -10.9415      2.00000
     12     -10.6512      2.00000
     13      -9.9955      2.00000
     14      -9.4976      2.00000
     15      -8.6768      2.00000
     16      -7.8473      2.00000
     17      -5.0417      2.00000
     18      -4.1516      2.00000
     19      -3.9042      2.00000
     20      -3.2612      2.00000
     21       0.5743      0.00000
     22       0.6768      0.00000
     23       1.5147      0.00000
     24       1.7428      0.00000
     25       2.0781      0.00000
     26       2.5328      0.00000
     27       2.7845      0.00000
     28       2.8860      0.00000

 k-point   125 :       0.1875    0.0000    0.3333
  band No.  band energies     occupation 
      1     -25.4756      2.00000
      2     -21.5239      2.00000
      3     -21.2081      2.00000
      4     -20.5207      2.00000
      5     -16.2925      2.00000
      6     -15.9147      2.00000
      7     -15.7213      2.00000
      8     -13.0773      2.00000
      9     -12.4432      2.00000
     10     -11.2881      2.00000
     11     -10.8388      2.00000
     12     -10.2642      2.00000
     13     -10.1054      2.00000
     14      -9.6917      2.00000
     15      -8.8939      2.00000
     16      -8.0038      2.00000
     17      -4.9635      2.00000
     18      -4.3021      2.00000
     19      -4.1043      2.00000
     20      -3.3735      2.00000
     21       0.6981      0.00000
     22       0.8319      0.00000
     23       1.6961      0.00000
     24       1.9203      0.00000
     25       2.2490      0.00000
     26       2.6967      0.00000
     27       3.0163      0.00000
     28       3.1348      0.00000

 k-point   126 :       0.2500    0.0000    0.3333
  band No.  band energies     occupation 
      1     -25.2890      2.00000
      2     -22.0707      2.00000
      3     -21.0810      2.00000
      4     -20.4545      2.00000
      5     -16.6641      2.00000
      6     -16.1337      2.00000
      7     -15.1889      2.00000
      8     -12.8578      2.00000
      9     -12.3057      2.00000
     10     -10.8866      2.00000
     11     -10.7133      2.00000
     12     -10.2806      2.00000
     13      -9.8606      2.00000
     14      -9.8413      2.00000
     15      -9.1422      2.00000
     16      -8.1835      2.00000
     17      -4.8510      2.00000
     18      -4.5159      2.00000
     19      -4.3440      2.00000
     20      -3.5195      2.00000
     21       0.8819      0.00000
     22       1.0552      0.00000
     23       1.9506      0.00000
     24       2.1701      0.00000
     25       2.4901      0.00000
     26       2.9276      0.00000
     27       3.1733      0.00000
     28       3.5291      0.00000

 k-point   127 :       0.3125    0.0000    0.3333
  band No.  band energies     occupation 
      1     -25.0502      2.00000
      2     -22.6092      2.00000
      3     -20.9295      2.00000
      4     -20.3963      2.00000
      5     -16.9852      2.00000
      6     -16.5248      2.00000
      7     -14.4432      2.00000
      8     -12.6077      2.00000
      9     -12.1560      2.00000
     10     -10.7880      2.00000
     11     -10.6029      2.00000
     12     -10.5198      2.00000
     13      -9.7850      2.00000
     14      -9.4497      2.00000
     15      -9.3588      2.00000
     16      -8.3785      2.00000
     17      -4.7567      2.00000
     18      -4.7088      2.00000
     19      -4.5938      2.00000
     20      -3.6866      2.00000
     21       1.1293      0.00000
     22       1.3490      0.00000
     23       2.2780      0.00000
     24       2.4924      0.00000
     25       2.7986      0.00000
     26       3.2006      0.00000
     27       3.3247      0.00000
     28       3.4433      0.00000

 k-point   128 :       0.3750    0.0000    0.3333
  band No.  band energies     occupation 
      1     -24.7601      2.00000
      2     -23.1214      2.00000
      3     -20.7653      2.00000
      4     -20.3678      2.00000
      5     -17.2144      2.00000
      6     -16.8658      2.00000
      7     -13.7154      2.00000
      8     -12.3260      2.00000
      9     -12.0481      2.00000
     10     -11.0129      2.00000
     11     -10.7794      2.00000
     12     -10.5852      2.00000
     13      -9.4730      2.00000
     14      -9.4452      2.00000
     15      -9.1498      2.00000
     16      -8.5976      2.00000
     17      -4.9656      2.00000
     18      -4.8231      2.00000
     19      -4.5463      2.00000
     20      -3.8614      2.00000
     21       1.4383      0.00000
     22       1.7125      0.00000
     23       2.6775      0.00000
     24       2.8847      0.00000
     25       3.0303      0.00000
     26       3.1203      0.00000
     27       3.3175      0.00000
     28       3.6409      0.00000

 k-point   129 :       0.4375    0.0000    0.3333
  band No.  band energies     occupation 
      1     -24.4200      2.00000
      2     -23.5975      2.00000
      3     -20.6057      2.00000
      4     -20.3906      2.00000
      5     -17.3204      2.00000
      6     -17.1297      2.00000
      7     -13.0434      2.00000
      8     -12.1184      2.00000
      9     -12.0151      2.00000
     10     -11.3384      2.00000
     11     -10.9294      2.00000
     12     -10.7030      2.00000
     13      -9.3411      2.00000
     14      -9.1754      2.00000
     15      -8.9909      2.00000
     16      -8.8481      2.00000
     17      -5.0881      2.00000
     18      -5.0013      2.00000
     19      -4.3756      2.00000
     20      -4.0346      2.00000
     21       1.7987      0.00000
     22       2.1419      0.00000
     23       2.5976      0.00000
     24       3.0844      0.00000
     25       3.1719      0.00000
     26       3.1815      0.00000
     27       3.3683      0.00000
     28       3.4016      0.00000

 k-point   130 :       0.5000    0.0000    0.3333
  band No.  band energies     occupation 
      1     -24.0320      2.00000
      2     -24.0311      2.00000
      3     -20.4741      2.00000
      4     -20.4726      2.00000
      5     -17.2908      2.00000
      6     -17.2877      2.00000
      7     -12.4807      2.00000
      8     -12.4779      2.00000
      9     -11.6824      2.00000
     10     -11.6809      2.00000
     11     -10.8676      2.00000
     12     -10.8664      2.00000
     13      -9.1139      2.00000
     14      -9.1123      2.00000
     15      -9.0015      2.00000
     16      -9.0002      2.00000
     17      -5.1003      2.00000
     18      -5.0955      2.00000
     19      -4.2062      2.00000
     20      -4.2034      2.00000
     21       2.1903      0.00000
     22       2.1907      0.00000
     23       2.6306      0.00000
     24       2.6323      0.00000
     25       3.1518      0.00000
     26       3.1521      0.00000
     27       3.7067      0.00000
     28       3.7068      0.00000

 k-point   131 :      -0.4375    0.0000    0.3333
  band No.  band energies     occupation 
      1     -24.4200      2.00000
      2     -23.5975      2.00000
      3     -20.6057      2.00000
      4     -20.3906      2.00000
      5     -17.3204      2.00000
      6     -17.1297      2.00000
      7     -13.0434      2.00000
      8     -12.1184      2.00000
      9     -12.0151      2.00000
     10     -11.3384      2.00000
     11     -10.9294      2.00000
     12     -10.7030      2.00000
     13      -9.3411      2.00000
     14      -9.1754      2.00000
     15      -8.9909      2.00000
     16      -8.8481      2.00000
     17      -5.0881      2.00000
     18      -5.0013      2.00000
     19      -4.3756      2.00000
     20      -4.0346      2.00000
     21       1.7987      0.00000
     22       2.1419      0.00000
     23       2.5976      0.00000
     24       3.0843      0.00000
     25       3.1719      0.00000
     26       3.1817      0.00000
     27       3.3682      0.00000
     28       3.4016      0.00000

 k-point   132 :      -0.3750    0.0000    0.3333
  band No.  band energies     occupation 
      1     -24.7601      2.00000
      2     -23.1214      2.00000
      3     -20.7653      2.00000
      4     -20.3678      2.00000
      5     -17.2144      2.00000
      6     -16.8658      2.00000
      7     -13.7154      2.00000
      8     -12.3260      2.00000
      9     -12.0481      2.00000
     10     -11.0129      2.00000
     11     -10.7794      2.00000
     12     -10.5852      2.00000
     13      -9.4730      2.00000
     14      -9.4452      2.00000
     15      -9.1498      2.00000
     16      -8.5976      2.00000
     17      -4.9656      2.00000
     18      -4.8231      2.00000
     19      -4.5463      2.00000
     20      -3.8614      2.00000
     21       1.4383      0.00000
     22       1.7125      0.00000
     23       2.6775      0.00000
     24       2.8847      0.00000
     25       3.0303      0.00000
     26       3.1201      0.00000
     27       3.3178      0.00000
     28       3.6418      0.00000

 k-point   133 :      -0.3125    0.0000    0.3333
  band No.  band energies     occupation 
      1     -25.0502      2.00000
      2     -22.6092      2.00000
      3     -20.9295      2.00000
      4     -20.3963      2.00000
      5     -16.9852      2.00000
      6     -16.5248      2.00000
      7     -14.4432      2.00000
      8     -12.6077      2.00000
      9     -12.1560      2.00000
     10     -10.7880      2.00000
     11     -10.6029      2.00000
     12     -10.5198      2.00000
     13      -9.7850      2.00000
     14      -9.4497      2.00000
     15      -9.3588      2.00000
     16      -8.3785      2.00000
     17      -4.7567      2.00000
     18      -4.7088      2.00000
     19      -4.5938      2.00000
     20      -3.6866      2.00000
     21       1.1293      0.00000
     22       1.3490      0.00000
     23       2.2780      0.00000
     24       2.4925      0.00000
     25       2.7985      0.00000
     26       3.2009      0.00000
     27       3.3245      0.00000
     28       3.4433      0.00000

 k-point   134 :      -0.2500    0.0000    0.3333
  band No.  band energies     occupation 
      1     -25.2890      2.00000
      2     -22.0707      2.00000
      3     -21.0810      2.00000
      4     -20.4545      2.00000
      5     -16.6641      2.00000
      6     -16.1337      2.00000
      7     -15.1889      2.00000
      8     -12.8578      2.00000
      9     -12.3057      2.00000
     10     -10.8866      2.00000
     11     -10.7133      2.00000
     12     -10.2806      2.00000
     13      -9.8606      2.00000
     14      -9.8413      2.00000
     15      -9.1422      2.00000
     16      -8.1835      2.00000
     17      -4.8510      2.00000
     18      -4.5159      2.00000
     19      -4.3440      2.00000
     20      -3.5195      2.00000
     21       0.8819      0.00000
     22       1.0552      0.00000
     23       1.9505      0.00000
     24       2.1701      0.00000
     25       2.4901      0.00000
     26       2.9277      0.00000
     27       3.1733      0.00000
     28       3.5289      0.00000

 k-point   135 :      -0.1875    0.0000    0.3333
  band No.  band energies     occupation 
      1     -25.4756      2.00000
      2     -21.5239      2.00000
      3     -21.2081      2.00000
      4     -20.5207      2.00000
      5     -16.2925      2.00000
      6     -15.9147      2.00000
      7     -15.7213      2.00000
      8     -13.0773      2.00000
      9     -12.4432      2.00000
     10     -11.2881      2.00000
     11     -10.8388      2.00000
     12     -10.2642      2.00000
     13     -10.1054      2.00000
     14      -9.6917      2.00000
     15      -8.8939      2.00000
     16      -8.0038      2.00000
     17      -4.9635      2.00000
     18      -4.3021      2.00000
     19      -4.1043      2.00000
     20      -3.3735      2.00000
     21       0.6981      0.00000
     22       0.8319      0.00000
     23       1.6961      0.00000
     24       1.9203      0.00000
     25       2.2489      0.00000
     26       2.6967      0.00000
     27       3.0162      0.00000
     28       3.1348      0.00000

 k-point   136 :      -0.1250    0.0000    0.3333
  band No.  band energies     occupation 
      1     -25.6093      2.00000
      2     -21.3032      2.00000
      3     -21.0054      2.00000
      4     -20.5781      2.00000
      5     -16.5701      2.00000
      6     -15.9230      2.00000
      7     -15.3267      2.00000
      8     -13.2681      2.00000
      9     -12.5490      2.00000
     10     -11.7366      2.00000
     11     -10.9415      2.00000
     12     -10.6512      2.00000
     13      -9.9955      2.00000
     14      -9.4976      2.00000
     15      -8.6768      2.00000
     16      -7.8473      2.00000
     17      -5.0417      2.00000
     18      -4.1516      2.00000
     19      -3.9042      2.00000
     20      -3.2612      2.00000
     21       0.5743      0.00000
     22       0.6768      0.00000
     23       1.5147      0.00000
     24       1.7428      0.00000
     25       2.0780      0.00000
     26       2.5329      0.00000
     27       2.7845      0.00000
     28       2.8866      0.00000

 k-point   137 :      -0.0625    0.0000    0.3333
  band No.  band energies     occupation 
      1     -25.6896      2.00000
      2     -21.3618      2.00000
      3     -20.6163      2.00000
      4     -20.5933      2.00000
      5     -17.0678      2.00000
      6     -15.6314      2.00000
      7     -15.0145      2.00000
      8     -13.4199      2.00000
      9     -12.6149      2.00000
     10     -12.0874      2.00000
     11     -11.0068      2.00000
     12     -10.9290      2.00000
     13      -9.9380      2.00000
     14      -9.3619      2.00000
     15      -8.5301      2.00000
     16      -7.7372      2.00000
     17      -5.0864      2.00000
     18      -4.0701      2.00000
     19      -3.7708      2.00000
     20      -3.1910      2.00000
     21       0.5042      0.00000
     22       0.5859      0.00000
     23       1.4061      0.00000
     24       1.6368      0.00000
     25       1.9765      0.00000
     26       2.4355      0.00000
     27       2.5520      0.00000
     28       2.7841      0.00000

 k-point   138 :       0.0000    0.0667    0.3333
  band No.  band energies     occupation 
      1     -25.6920      2.00000
      2     -21.6180      2.00000
      3     -20.4166      2.00000
      4     -20.4059      2.00000
      5     -17.2540      2.00000
      6     -15.7482      2.00000
      7     -14.6390      2.00000
      8     -13.4492      2.00000
      9     -12.7151      2.00000
     10     -12.3273      2.00000
     11     -11.0079      2.00000
     12     -10.8993      2.00000
     13      -9.9042      2.00000
     14      -9.2901      2.00000
     15      -8.5400      2.00000
     16      -7.6818      2.00000
     17      -5.1238      2.00000
     18      -4.0548      2.00000
     19      -3.7400      2.00000
     20      -3.1895      2.00000
     21       0.5026      0.00000
     22       0.5759      0.00000
     23       1.4052      0.00000
     24       1.6339      0.00000
     25       1.9743      0.00000
     26       2.4118      0.00000
     27       2.5157      0.00000
     28       2.6126      0.00000

 k-point   139 :       0.0625    0.0667    0.3333
  band No.  band energies     occupation 
      1     -25.6652      2.00000
      2     -21.5971      2.00000
      3     -20.5737      2.00000
      4     -20.4062      2.00000
      5     -17.0580      2.00000
      6     -15.8601      2.00000
      7     -14.7666      2.00000
      8     -13.3812      2.00000
      9     -12.6911      2.00000
     10     -12.1952      2.00000
     11     -10.9895      2.00000
     12     -10.7970      2.00000
     13      -9.9218      2.00000
     14      -9.3371      2.00000
     15      -8.5885      2.00000
     16      -7.7205      2.00000
     17      -5.1106      2.00000
     18      -4.0792      2.00000
     19      -3.7864      2.00000
     20      -3.2139      2.00000
     21       0.5253      0.00000
     22       0.6056      0.00000
     23       1.4414      0.00000
     24       1.6691      0.00000
     25       2.0079      0.00000
     26       2.4462      0.00000
     27       2.5883      0.00000
     28       2.6824      0.00000

 k-point   140 :       0.1250    0.0667    0.3333
  band No.  band energies     occupation 
      1     -25.5848      2.00000
      2     -21.5351      2.00000
      3     -20.9850      2.00000
      4     -20.3777      2.00000
      5     -16.5635      2.00000
      6     -16.1402      2.00000
      7     -15.0817      2.00000
      8     -13.2242      2.00000
      9     -12.6199      2.00000
     10     -11.8509      2.00000
     11     -10.9377      2.00000
     12     -10.5222      2.00000
     13      -9.9777      2.00000
     14      -9.4703      2.00000
     15      -8.7234      2.00000
     16      -7.8291      2.00000
     17      -5.0691      2.00000
     18      -4.1599      2.00000
     19      -3.9181      2.00000
     20      -3.2858      2.00000
     21       0.5959      0.00000
     22       0.6957      0.00000
     23       1.5500      0.00000
     24       1.7750      0.00000
     25       2.1094      0.00000
     26       2.5452      0.00000
     27       2.7971      0.00000
     28       2.8517      0.00000

 k-point   141 :       0.1875    0.0667    0.3333
  band No.  band energies     occupation 
      1     -25.4512      2.00000
      2     -21.5028      2.00000
      3     -21.4338      2.00000
      4     -20.3385      2.00000
      5     -16.4886      2.00000
      6     -15.9133      2.00000
      7     -15.4829      2.00000
      8     -13.0295      2.00000
      9     -12.5048      2.00000
     10     -11.3988      2.00000
     11     -10.8662      2.00000
     12     -10.1499      2.00000
     13     -10.0752      2.00000
     14      -9.6596      2.00000
     15      -8.9189      2.00000
     16      -7.9877      2.00000
     17      -4.9950      2.00000
     18      -4.3088      2.00000
     19      -4.1159      2.00000
     20      -3.4004      2.00000
     21       0.7205      0.00000
     22       0.8494      0.00000
     23       1.7315      0.00000
     24       1.9521      0.00000
     25       2.2801      0.00000
     26       2.7083      0.00000
     27       3.0207      0.00000
     28       3.1177      0.00000

 k-point   142 :       0.2500    0.0667    0.3333
  band No.  band energies     occupation 
      1     -25.2647      2.00000
      2     -22.0490      2.00000
      3     -21.2967      2.00000
      4     -20.3024      2.00000
      5     -16.8270      2.00000
      6     -15.9065      2.00000
      7     -15.1956      2.00000
      8     -12.8082      2.00000
      9     -12.3537      2.00000
     10     -10.9664      2.00000
     11     -10.8150      2.00000
     12     -10.1962      2.00000
     13      -9.9002      2.00000
     14      -9.6915      2.00000
     15      -9.1422      2.00000
     16      -8.1732      2.00000
     17      -4.8869      2.00000
     18      -4.5202      2.00000
     19      -4.3535      2.00000
     20      -3.5491      2.00000
     21       0.9053      0.00000
     22       1.0705      0.00000
     23       1.9859      0.00000
     24       2.2013      0.00000
     25       2.5208      0.00000
     26       2.9371      0.00000
     27       3.1796      0.00000
     28       3.4516      0.00000

 k-point   143 :       0.3125    0.0667    0.3333
  band No.  band energies     occupation 
      1     -25.0261      2.00000
      2     -22.5869      2.00000
      3     -21.1296      2.00000
      4     -20.2893      2.00000
      5     -17.0995      2.00000
      6     -16.3152      2.00000
      7     -14.4619      2.00000
      8     -12.5578      2.00000
      9     -12.1880      2.00000
     10     -10.8643      2.00000
     11     -10.7956      2.00000
     12     -10.2854      2.00000
     13      -9.8508      2.00000
     14      -9.3512      2.00000
     15      -9.3439      2.00000
     16      -8.3736      2.00000
     17      -4.7586      2.00000
     18      -4.7484      2.00000
     19      -4.6014      2.00000
     20      -3.7189      2.00000
     21       1.1536      0.00000
     22       1.3619      0.00000
     23       2.3133      0.00000
     24       2.5230      0.00000
     25       2.8275      0.00000
     26       3.1814      0.00000
     27       3.2870      0.00000
     28       3.5437      0.00000

 k-point   144 :       0.3750    0.0667    0.3333
  band No.  band energies     occupation 
      1     -24.7361      2.00000
      2     -23.0986      2.00000
      3     -20.9413      2.00000
      4     -20.3219      2.00000
      5     -17.2647      2.00000
      6     -16.6824      2.00000
      7     -13.7510      2.00000
      8     -12.2768      2.00000
      9     -12.0753      2.00000
     10     -11.0002      2.00000
     11     -10.9841      2.00000
     12     -10.3791      2.00000
     13      -9.5447      2.00000
     14      -9.4268      2.00000
     15      -9.0865      2.00000
     16      -8.5937      2.00000
     17      -4.9663      2.00000
     18      -4.8291      2.00000
     19      -4.5886      2.00000
     20      -3.8966      2.00000
     21       1.4632      0.00000
     22       1.7227      0.00000
     23       2.7123      0.00000
     24       2.9094      0.00000
     25       2.9745      0.00000
     26       3.1899      0.00000
     27       3.3718      0.00000
     28       3.6348      0.00000

 k-point   145 :       0.4375    0.0667    0.3333
  band No.  band energies     occupation 
      1     -24.3962      2.00000
      2     -23.5743      2.00000
      3     -20.7457      2.00000
      4     -20.4142      2.00000
      5     -17.2981      2.00000
      6     -16.9850      2.00000
      7     -13.0996      2.00000
      8     -12.1742      2.00000
      9     -11.9676      2.00000
     10     -11.2986      2.00000
     11     -11.0187      2.00000
     12     -10.5819      2.00000
     13      -9.3221      2.00000
     14      -9.2233      2.00000
     15      -8.9655      2.00000
     16      -8.8402      2.00000
     17      -5.0891      2.00000
     18      -5.0055      2.00000
     19      -4.4186      2.00000
     20      -4.0730      2.00000
     21       1.8235      0.00000
     22       2.1490      0.00000
     23       2.6050      0.00000
     24       3.1143      0.00000
     25       3.1687      0.00000
     26       3.2131      0.00000
     27       3.3933      0.00000
     28       3.4361      0.00000

 k-point   146 :       0.5000    0.0667    0.3333
  band No.  band energies     occupation 
      1     -24.0086      2.00000
      2     -24.0076      2.00000
      3     -20.5628      2.00000
      4     -20.5614      2.00000
      5     -17.2001      2.00000
      6     -17.1972      2.00000
      7     -12.5515      2.00000
      8     -12.5489      2.00000
      9     -11.6377      2.00000
     10     -11.6362      2.00000
     11     -10.8374      2.00000
     12     -10.8362      2.00000
     13      -9.0995      2.00000
     14      -9.0980      2.00000
     15      -9.0148      2.00000
     16      -9.0134      2.00000
     17      -5.1026      2.00000
     18      -5.0979      2.00000
     19      -4.2476      2.00000
     20      -4.2448      2.00000
     21       2.2127      0.00000
     22       2.2131      0.00000
     23       2.6337      0.00000
     24       2.6354      0.00000
     25       3.1741      0.00000
     26       3.1746      0.00000
     27       3.7417      0.00000
     28       3.7417      0.00000

 k-point   147 :      -0.4375    0.0667    0.3333
  band No.  band energies     occupation 
      1     -24.3962      2.00000
      2     -23.5743      2.00000
      3     -20.7456      2.00000
      4     -20.4142      2.00000
      5     -17.2976      2.00000
      6     -16.9854      2.00000
      7     -13.0994      2.00000
      8     -12.1748      2.00000
      9     -11.9675      2.00000
     10     -11.2987      2.00000
     11     -11.0183      2.00000
     12     -10.5818      2.00000
     13      -9.3219      2.00000
     14      -9.2224      2.00000
     15      -8.9664      2.00000
     16      -8.8405      2.00000
     17      -5.0892      2.00000
     18      -5.0053      2.00000
     19      -4.4190      2.00000
     20      -4.0726      2.00000
     21       1.8234      0.00000
     22       2.1490      0.00000
     23       2.6048      0.00000
     24       3.1145      0.00000
     25       3.1688      0.00000
     26       3.2133      0.00000
     27       3.3931      0.00000
     28       3.4358      0.00000

 k-point   148 :      -0.3750    0.0667    0.3333
  band No.  band energies     occupation 
      1     -24.7361      2.00000
      2     -23.0986      2.00000
      3     -20.9413      2.00000
      4     -20.3219      2.00000
      5     -17.2642      2.00000
      6     -16.6829      2.00000
      7     -13.7508      2.00000
      8     -12.2767      2.00000
      9     -12.0758      2.00000
     10     -11.0001      2.00000
     11     -10.9843      2.00000
     12     -10.3786      2.00000
     13      -9.5437      2.00000
     14      -9.4268      2.00000
     15      -9.0873      2.00000
     16      -8.5940      2.00000
     17      -4.9665      2.00000
     18      -4.8289      2.00000
     19      -4.5891      2.00000
     20      -3.8962      2.00000
     21       1.4631      0.00000
     22       1.7226      0.00000
     23       2.7122      0.00000
     24       2.9094      0.00000
     25       2.9739      0.00000
     26       3.1897      0.00000
     27       3.3727      0.00000
     28       3.6347      0.00000

 k-point   149 :      -0.3125    0.0667    0.3333
  band No.  band energies     occupation 
      1     -25.0261      2.00000
      2     -22.5869      2.00000
      3     -21.1296      2.00000
      4     -20.2894      2.00000
      5     -17.0991      2.00000
      6     -16.3157      2.00000
      7     -14.4618      2.00000
      8     -12.5577      2.00000
      9     -12.1883      2.00000
     10     -10.8647      2.00000
     11     -10.7957      2.00000
     12     -10.2845      2.00000
     13      -9.8497      2.00000
     14      -9.3521      2.00000
     15      -9.3439      2.00000
     16      -8.3739      2.00000
     17      -4.7589      2.00000
     18      -4.7488      2.00000
     19      -4.6011      2.00000
     20      -3.7186      2.00000
     21       1.1535      0.00000
     22       1.3619      0.00000
     23       2.3133      0.00000
     24       2.5230      0.00000
     25       2.8273      0.00000
     26       3.1812      0.00000
     27       3.2865      0.00000
     28       3.5445      0.00000

 k-point   150 :      -0.2500    0.0667    0.3333
  band No.  band energies     occupation 
      1     -25.2648      2.00000
      2     -22.0490      2.00000
      3     -21.2967      2.00000
      4     -20.3024      2.00000
      5     -16.8265      2.00000
      6     -15.9071      2.00000
      7     -15.1955      2.00000
      8     -12.8081      2.00000
      9     -12.3538      2.00000
     10     -10.9661      2.00000
     11     -10.8155      2.00000
     12     -10.1953      2.00000
     13      -9.8995      2.00000
     14      -9.6923      2.00000
     15      -9.1422      2.00000
     16      -8.1735      2.00000
     17      -4.8873      2.00000
     18      -4.5204      2.00000
     19      -4.3532      2.00000
     20      -3.5488      2.00000
     21       0.9052      0.00000
     22       1.0705      0.00000
     23       1.9859      0.00000
     24       2.2014      0.00000
     25       2.5207      0.00000
     26       2.9371      0.00000
     27       3.1791      0.00000
     28       3.4517      0.00000

 k-point   151 :      -0.1875    0.0667    0.3333
  band No.  band energies     occupation 
      1     -25.4512      2.00000
      2     -21.5028      2.00000
      3     -21.4338      2.00000
      4     -20.3386      2.00000
      5     -16.4882      2.00000
      6     -15.9133      2.00000
      7     -15.4835      2.00000
      8     -13.0294      2.00000
      9     -12.5049      2.00000
     10     -11.3983      2.00000
     11     -10.8665      2.00000
     12     -10.1505      2.00000
     13     -10.0747      2.00000
     14      -9.6594      2.00000
     15      -8.9188      2.00000
     16      -7.9879      2.00000
     17      -4.9954      2.00000
     18      -4.3090      2.00000
     19      -4.1157      2.00000
     20      -3.4002      2.00000
     21       0.7205      0.00000
     22       0.8493      0.00000
     23       1.7314      0.00000
     24       1.9521      0.00000
     25       2.2800      0.00000
     26       2.7083      0.00000
     27       3.0206      0.00000
     28       3.1179      0.00000

 k-point   152 :      -0.1250    0.0667    0.3333
  band No.  band energies     occupation 
      1     -25.5848      2.00000
      2     -21.5351      2.00000
      3     -20.9850      2.00000
      4     -20.3777      2.00000
      5     -16.5635      2.00000
      6     -16.1398      2.00000
      7     -15.0824      2.00000
      8     -13.2241      2.00000
      9     -12.6200      2.00000
     10     -11.8503      2.00000
     11     -10.9379      2.00000
     12     -10.5227      2.00000
     13      -9.9774      2.00000
     14      -9.4701      2.00000
     15      -8.7233      2.00000
     16      -7.8293      2.00000
     17      -5.0693      2.00000
     18      -4.1601      2.00000
     19      -3.9179      2.00000
     20      -3.2856      2.00000
     21       0.5959      0.00000
     22       0.6957      0.00000
     23       1.5500      0.00000
     24       1.7750      0.00000
     25       2.1094      0.00000
     26       2.5452      0.00000
     27       2.7971      0.00000
     28       2.8521      0.00000

 k-point   153 :      -0.0625    0.0667    0.3333
  band No.  band energies     occupation 
      1     -25.6652      2.00000
      2     -21.5971      2.00000
      3     -20.5737      2.00000
      4     -20.4062      2.00000
      5     -17.0580      2.00000
      6     -15.8598      2.00000
      7     -14.7671      2.00000
      8     -13.3811      2.00000
      9     -12.6911      2.00000
     10     -12.1948      2.00000
     11     -10.9896      2.00000
     12     -10.7973      2.00000
     13      -9.9217      2.00000
     14      -9.3370      2.00000
     15      -8.5884      2.00000
     16      -7.7206      2.00000
     17      -5.1108      2.00000
     18      -4.0793      2.00000
     19      -3.7863      2.00000
     20      -3.2139      2.00000
     21       0.5253      0.00000
     22       0.6056      0.00000
     23       1.4414      0.00000
     24       1.6691      0.00000
     25       2.0079      0.00000
     26       2.4463      0.00000
     27       2.5883      0.00000
     28       2.6827      0.00000

 k-point   154 :       0.0000    0.1333    0.3333
  band No.  band energies     occupation 
      1     -25.6188      2.00000
      2     -22.0477      2.00000
      3     -20.3485      2.00000
      4     -20.0600      2.00000
      5     -17.2228      2.00000
      6     -16.1208      2.00000
      7     -14.2128      2.00000
      8     -13.3736      2.00000
      9     -12.9185      2.00000
     10     -12.5110      2.00000
     11     -10.9668      2.00000
     12     -10.6035      2.00000
     13      -9.8687      2.00000
     14      -9.2195      2.00000
     15      -8.7043      2.00000
     16      -7.6507      2.00000
     17      -5.1838      2.00000
     18      -4.0829      2.00000
     19      -3.7932      2.00000
     20      -3.2562      2.00000
     21       0.5673      0.00000
     22       0.6358      0.00000
     23       1.5111      0.00000
     24       1.7309      0.00000
     25       2.0680      0.00000
     26       2.4480      0.00000
     27       2.5820      0.00000
     28       2.6346      0.00000

 k-point   155 :       0.0625    0.1333    0.3333
  band No.  band energies     occupation 
      1     -25.5920      2.00000
      2     -22.0253      2.00000
      3     -20.5151      2.00000
      4     -20.0577      2.00000
      5     -17.0302      2.00000
      6     -16.2222      2.00000
      7     -14.3419      2.00000
      8     -13.2928      2.00000
      9     -12.8902      2.00000
     10     -12.3935      2.00000
     11     -10.9596      2.00000
     12     -10.5042      2.00000
     13      -9.8860      2.00000
     14      -9.2634      2.00000
     15      -8.7425      2.00000
     16      -7.6856      2.00000
     17      -5.1740      2.00000
     18      -4.1067      2.00000
     19      -3.8382      2.00000
     20      -3.2822      2.00000
     21       0.5906      0.00000
     22       0.6648      0.00000
     23       1.5473      0.00000
     24       1.7658      0.00000
     25       2.1015      0.00000
     26       2.4803      0.00000
     27       2.6525      0.00000
     28       2.6941      0.00000

 k-point   156 :       0.1250    0.1333    0.3333
  band No.  band energies     occupation 
      1     -25.5118      2.00000
      2     -21.9587      2.00000
      3     -20.9244      2.00000
      4     -20.0549      2.00000
      5     -16.5456      2.00000
      6     -16.4717      2.00000
      7     -14.6597      2.00000
      8     -13.1105      2.00000
      9     -12.8054      2.00000
     10     -12.0752      2.00000
     11     -10.9460      2.00000
     12     -10.2426      2.00000
     13      -9.9356      2.00000
     14      -9.3877      2.00000
     15      -8.8444      2.00000
     16      -7.7884      2.00000
     17      -5.1417      2.00000
     18      -4.1852      2.00000
     19      -3.9658      2.00000
     20      -3.3585      2.00000
     21       0.6628      0.00000
     22       0.7526      0.00000
     23       1.6560      0.00000
     24       1.8708      0.00000
     25       2.2024      0.00000
     26       2.5754      0.00000
     27       2.8329      0.00000
     28       2.8671      0.00000

 k-point   157 :       0.1875    0.1333    0.3333
  band No.  band energies     occupation 
      1     -25.3783      2.00000
      2     -21.8490      2.00000
      3     -21.4398      2.00000
      4     -20.0636      2.00000
      5     -16.7679      2.00000
      6     -15.9121      2.00000
      7     -15.0664      2.00000
      8     -12.8965      2.00000
      9     -12.6660      2.00000
     10     -11.6297      2.00000
     11     -10.9546      2.00000
     12     -10.0012      2.00000
     13      -9.9106      2.00000
     14      -9.5567      2.00000
     15      -8.9839      2.00000
     16      -7.9487      2.00000
     17      -5.0801      2.00000
     18      -4.3294      2.00000
     19      -4.1574      2.00000
     20      -3.4795      2.00000
     21       0.7898      0.00000
     22       0.9018      0.00000
     23       1.8374      0.00000
     24       2.0465      0.00000
     25       2.3720      0.00000
     26       2.7325      0.00000
     27       3.0435      0.00000
     28       3.1200      0.00000

 k-point   158 :       0.2500    0.1333    0.3333
  band No.  band energies     occupation 
      1     -25.1922      2.00000
      2     -21.9840      2.00000
      3     -21.6985      2.00000
      4     -20.1030      2.00000
      5     -17.0272      2.00000
      6     -15.5011      2.00000
      7     -15.2196      2.00000
      8     -12.6656      2.00000
      9     -12.4783      2.00000
     10     -11.1559      2.00000
     11     -11.0313      2.00000
     12     -10.0426      2.00000
     13      -9.8451      2.00000
     14      -9.4656      2.00000
     15      -9.1443      2.00000
     16      -8.1468      2.00000
     17      -4.9852      2.00000
     18      -4.5344      2.00000
     19      -4.3885      2.00000
     20      -3.6351      2.00000
     21       0.9773      0.00000
     22       1.1166      0.00000
     23       2.0918      0.00000
     24       2.2937      0.00000
     25       2.6107      0.00000
     26       2.9532      0.00000
     27       3.1865      0.00000
     28       3.4056      0.00000

 k-point   159 :       0.3125    0.1333    0.3333
  band No.  band energies     occupation 
      1     -24.9539      2.00000
      2     -22.5202      2.00000
      3     -21.5109      2.00000
      4     -20.1943      2.00000
      5     -17.1928      2.00000
      6     -15.9286      2.00000
      7     -14.5223      2.00000
      8     -12.4122      2.00000
      9     -12.2701      2.00000
     10     -11.1842      2.00000
     11     -10.8395      2.00000
     12     -10.0490      2.00000
     13      -9.9107      2.00000
     14      -9.3057      2.00000
     15      -9.1725      2.00000
     16      -8.3615      2.00000
     17      -4.8587      2.00000
     18      -4.7667      2.00000
     19      -4.6310      2.00000
     20      -3.8121      2.00000
     21       1.2280      0.00000
     22       1.4003      0.00000
     23       2.4190      0.00000
     24       2.6126      0.00000
     25       2.9086      0.00000
     26       3.1279      0.00000
     27       3.2666      0.00000
     28       3.6929      0.00000

 k-point   160 :       0.3750    0.1333    0.3333
  band No.  band energies     occupation 
      1     -24.6645      2.00000
      2     -23.0305      2.00000
      3     -21.2919      2.00000
      4     -20.3484      2.00000
      5     -17.2345      2.00000
      6     -16.3257      2.00000
      7     -13.8594      2.00000
      8     -12.1597      2.00000
      9     -12.1325      2.00000
     10     -11.2811      2.00000
     11     -10.9077      2.00000
     12     -10.1307      2.00000
     13      -9.6717      2.00000
     14      -9.3766      2.00000
     15      -8.9756      2.00000
     16      -8.5850      2.00000
     17      -4.9718      2.00000
     18      -4.8535      2.00000
     19      -4.7076      2.00000
     20      -3.9973      2.00000
     21       1.5390      0.00000
     22       1.7527      0.00000
     23       2.8135      0.00000
     24       2.8992      0.00000
     25       3.0095      0.00000
     26       3.2981      0.00000
     27       3.4955      0.00000
     28       3.6134      0.00000

 k-point   161 :       0.4375    0.1333    0.3333
  band No.  band energies     occupation 
      1     -24.3252      2.00000
      2     -23.5050      2.00000
      3     -21.0503      2.00000
      4     -20.5573      2.00000
      5     -17.1500      2.00000
      6     -16.6741      2.00000
      7     -13.2604      2.00000
      8     -12.3434      2.00000
      9     -11.8280      2.00000
     10     -11.1837      2.00000
     11     -11.1079      2.00000
     12     -10.3943      2.00000
     13      -9.3225      2.00000
     14      -9.2704      2.00000
     15      -8.9297      2.00000
     16      -8.8205      2.00000
     17      -5.0965      2.00000
     18      -5.0241      2.00000
     19      -4.5403      2.00000
     20      -4.1825      2.00000
     21       1.8988      0.00000
     22       2.1696      0.00000
     23       2.6359      0.00000
     24       3.1581      0.00000
     25       3.1942      0.00000
     26       3.3086      0.00000
     27       3.4691      0.00000
     28       3.5331      0.00000

 k-point   162 :       0.5000    0.1333    0.3333
  band No.  band energies     occupation 
      1     -23.9383      2.00000
      2     -23.9374      2.00000
      3     -20.7996      2.00000
      4     -20.7987      2.00000
      5     -16.9569      2.00000
      6     -16.9546      2.00000
      7     -12.7464      2.00000
      8     -12.7441      2.00000
      9     -11.5066      2.00000
     10     -11.5052      2.00000
     11     -10.7595      2.00000
     12     -10.7583      2.00000
     13      -9.0613      2.00000
     14      -9.0598      2.00000
     15      -9.0528      2.00000
     16      -9.0514      2.00000
     17      -5.1150      2.00000
     18      -5.1106      2.00000
     19      -4.3653      2.00000
     20      -4.3627      2.00000
     21       2.2824      0.00000
     22       2.2829      0.00000
     23       2.6422      0.00000
     24       2.6439      0.00000
     25       3.2406      0.00000
     26       3.2413      0.00000
     27       3.8453      0.00000
     28       3.8454      0.00000

 k-point   163 :      -0.4375    0.1333    0.3333
  band No.  band energies     occupation 
      1     -24.3252      2.00000
      2     -23.5050      2.00000
      3     -21.0503      2.00000
      4     -20.5574      2.00000
      5     -17.1495      2.00000
      6     -16.6746      2.00000
      7     -13.2600      2.00000
      8     -12.3442      2.00000
      9     -11.8278      2.00000
     10     -11.1839      2.00000
     11     -11.1076      2.00000
     12     -10.3940      2.00000
     13      -9.3213      2.00000
     14      -9.2700      2.00000
     15      -8.9309      2.00000
     16      -8.8210      2.00000
     17      -5.0968      2.00000
     18      -5.0238      2.00000
     19      -4.5411      2.00000
     20      -4.1817      2.00000
     21       1.8987      0.00000
     22       2.1695      0.00000
     23       2.6356      0.00000
     24       3.1583      0.00000
     25       3.1946      0.00000
     26       3.3087      0.00000
     27       3.4689      0.00000
     28       3.5326      0.00000

 k-point   164 :      -0.3750    0.1333    0.3333
  band No.  band energies     occupation 
      1     -24.6645      2.00000
      2     -23.0305      2.00000
      3     -21.2919      2.00000
      4     -20.3485      2.00000
      5     -17.2340      2.00000
      6     -16.3263      2.00000
      7     -13.8592      2.00000
      8     -12.1605      2.00000
      9     -12.1323      2.00000
     10     -11.2808      2.00000
     11     -10.9080      2.00000
     12     -10.1299      2.00000
     13      -9.6704      2.00000
     14      -9.3766      2.00000
     15      -8.9766      2.00000
     16      -8.5856      2.00000
     17      -4.9721      2.00000
     18      -4.8532      2.00000
     19      -4.7084      2.00000
     20      -3.9966      2.00000
     21       1.5388      0.00000
     22       1.7527      0.00000
     23       2.8134      0.00000
     24       2.8988      0.00000
     25       3.0094      0.00000
     26       3.2978      0.00000
     27       3.4966      0.00000
     28       3.6130      0.00000

 k-point   165 :      -0.3125    0.1333    0.3333
  band No.  band energies     occupation 
      1     -24.9539      2.00000
      2     -22.5202      2.00000
      3     -21.5109      2.00000
      4     -20.1944      2.00000
      5     -17.1923      2.00000
      6     -15.9292      2.00000
      7     -14.5222      2.00000
      8     -12.4120      2.00000
      9     -12.2706      2.00000
     10     -11.1844      2.00000
     11     -10.8394      2.00000
     12     -10.0477      2.00000
     13      -9.9096      2.00000
     14      -9.3060      2.00000
     15      -9.1734      2.00000
     16      -8.3620      2.00000
     17      -4.8595      2.00000
     18      -4.7669      2.00000
     19      -4.6306      2.00000
     20      -3.8115      2.00000
     21       1.2278      0.00000
     22       1.4002      0.00000
     23       2.4190      0.00000
     24       2.6126      0.00000
     25       2.9082      0.00000
     26       3.1276      0.00000
     27       3.2663      0.00000
     28       3.6926      0.00000

 k-point   166 :      -0.2500    0.1333    0.3333
  band No.  band energies     occupation 
      1     -25.1922      2.00000
      2     -21.9840      2.00000
      3     -21.6985      2.00000
      4     -20.1031      2.00000
      5     -17.0267      2.00000
      6     -15.5018      2.00000
      7     -15.2195      2.00000
      8     -12.6654      2.00000
      9     -12.4785      2.00000
     10     -11.1553      2.00000
     11     -11.0319      2.00000
     12     -10.0412      2.00000
     13      -9.8447      2.00000
     14      -9.4662      2.00000
     15      -9.1445      2.00000
     16      -8.1473      2.00000
     17      -4.9860      2.00000
     18      -4.5347      2.00000
     19      -4.3881      2.00000
     20      -3.6346      2.00000
     21       0.9771      0.00000
     22       1.1165      0.00000
     23       2.0918      0.00000
     24       2.2937      0.00000
     25       2.6106      0.00000
     26       2.9531      0.00000
     27       3.1858      0.00000
     28       3.4058      0.00000

 k-point   167 :      -0.1875    0.1333    0.3333
  band No.  band energies     occupation 
      1     -25.3783      2.00000
      2     -21.8490      2.00000
      3     -21.4398      2.00000
      4     -20.0636      2.00000
      5     -16.7674      2.00000
      6     -15.9121      2.00000
      7     -15.0673      2.00000
      8     -12.8964      2.00000
      9     -12.6661      2.00000
     10     -11.6287      2.00000
     11     -10.9552      2.00000
     12     -10.0001      2.00000
     13      -9.9115      2.00000
     14      -9.5563      2.00000
     15      -8.9840      2.00000
     16      -7.9491      2.00000
     17      -5.0808      2.00000
     18      -4.3297      2.00000
     19      -4.1570      2.00000
     20      -3.4791      2.00000
     21       0.7896      0.00000
     22       0.9018      0.00000
     23       1.8374      0.00000
     24       2.0465      0.00000
     25       2.3719      0.00000
     26       2.7325      0.00000
     27       3.0432      0.00000
     28       3.1205      0.00000

 k-point   168 :      -0.1250    0.1333    0.3333
  band No.  band energies     occupation 
      1     -25.5118      2.00000
      2     -21.9587      2.00000
      3     -20.9243      2.00000
      4     -20.0550      2.00000
      5     -16.5456      2.00000
      6     -16.4714      2.00000
      7     -14.6606      2.00000
      8     -13.1105      2.00000
      9     -12.8055      2.00000
     10     -12.0740      2.00000
     11     -10.9464      2.00000
     12     -10.2433      2.00000
     13      -9.9349      2.00000
     14      -9.3873      2.00000
     15      -8.8444      2.00000
     16      -7.7886      2.00000
     17      -5.1422      2.00000
     18      -4.1855      2.00000
     19      -3.9654      2.00000
     20      -3.3582      2.00000
     21       0.6627      0.00000
     22       0.7526      0.00000
     23       1.6560      0.00000
     24       1.8709      0.00000
     25       2.2023      0.00000
     26       2.5754      0.00000
     27       2.8329      0.00000
     28       2.8676      0.00000

 k-point   169 :      -0.0625    0.1333    0.3333
  band No.  band energies     occupation 
      1     -25.5920      2.00000
      2     -22.0253      2.00000
      3     -20.5151      2.00000
      4     -20.0577      2.00000
      5     -17.0302      2.00000
      6     -16.2220      2.00000
      7     -14.3426      2.00000
      8     -13.2928      2.00000
      9     -12.8902      2.00000
     10     -12.3926      2.00000
     11     -10.9597      2.00000
     12     -10.5047      2.00000
     13      -9.8857      2.00000
     14      -9.2632      2.00000
     15      -8.7425      2.00000
     16      -7.6858      2.00000
     17      -5.1743      2.00000
     18      -4.1069      2.00000
     19      -3.8380      2.00000
     20      -3.2821      2.00000
     21       0.5906      0.00000
     22       0.6648      0.00000
     23       1.5473      0.00000
     24       1.7658      0.00000
     25       2.1014      0.00000
     26       2.4803      0.00000
     27       2.6527      0.00000
     28       2.6944      0.00000

 k-point   170 :       0.0000    0.2000    0.3333
  band No.  band energies     occupation 
      1     -25.4972      2.00000
      2     -22.5093      2.00000
      3     -20.2543      2.00000
      4     -19.7323      2.00000
      5     -17.1760      2.00000
      6     -16.4697      2.00000
      7     -13.7607      2.00000
      8     -13.3795      2.00000
      9     -13.1878      2.00000
     10     -12.5513      2.00000
     11     -10.9478      2.00000
     12     -10.2634      2.00000
     13      -9.8424      2.00000
     14      -9.1047      2.00000
     15      -8.9352      2.00000
     16      -7.6253      2.00000
     17      -5.2554      2.00000
     18      -4.1295      2.00000
     19      -3.8940      2.00000
     20      -3.3650      2.00000
     21       0.6810      0.00000
     22       0.7386      0.00000
     23       1.6879      0.00000
     24       1.8913      0.00000
     25       2.2213      0.00000
     26       2.5202      0.00000
     27       2.6285      0.00000
     28       2.8140      0.00000

 k-point   171 :       0.0625    0.2000    0.3333
  band No.  band energies     occupation 
      1     -25.4705      2.00000
      2     -22.4858      2.00000
      3     -20.4193      2.00000
      4     -19.7443      2.00000
      5     -16.9897      2.00000
      6     -16.5527      2.00000
      7     -13.8900      2.00000
      8     -13.2706      2.00000
      9     -13.1533      2.00000
     10     -12.4641      2.00000
     11     -10.9590      2.00000
     12     -10.1718      2.00000
     13      -9.8573      2.00000
     14      -9.1419      2.00000
     15      -8.9569      2.00000
     16      -7.6549      2.00000
     17      -5.2511      2.00000
     18      -4.1523      2.00000
     19      -3.9374      2.00000
     20      -3.3932      2.00000
     21       0.7052      0.00000
     22       0.7666      0.00000
     23       1.7241      0.00000
     24       1.9257      0.00000
     25       2.2543      0.00000
     26       2.5491      0.00000
     27       2.6978      0.00000
     28       2.8577      0.00000

 k-point   172 :       0.1250    0.2000    0.3333
  band No.  band energies     occupation 
      1     -25.3904      2.00000
      2     -22.4156      2.00000
      3     -20.8246      2.00000
      4     -19.7863      2.00000
      5     -16.7492      2.00000
      6     -16.5232      2.00000
      7     -14.2079      2.00000
      8     -13.0491      2.00000
      9     -13.0134      2.00000
     10     -12.2221      2.00000
     11     -11.0051      2.00000
     12      -9.9375      2.00000
     13      -9.8914      2.00000
     14      -9.2459      2.00000
     15      -9.0107      2.00000
     16      -7.7469      2.00000
     17      -5.2337      2.00000
     18      -4.2267      2.00000
     19      -4.0603      2.00000
     20      -3.4756      2.00000
     21       0.7799      0.00000
     22       0.8509      0.00000
     23       1.8327      0.00000
     24       2.0290      0.00000
     25       2.3535      0.00000
     26       2.6360      0.00000
     27       2.8802      0.00000
     28       2.9818      0.00000

 k-point   173 :       0.1875    0.2000    0.3333
  band No.  band energies     occupation 
      1     -25.2574      2.00000
      2     -22.2995      2.00000
      3     -21.3361      2.00000
      4     -19.8740      2.00000
      5     -16.9588      2.00000
      6     -15.9201      2.00000
      7     -14.6164      2.00000
      8     -12.8743      2.00000
      9     -12.7261      2.00000
     10     -11.8404      2.00000
     11     -11.1154      2.00000
     12      -9.9143      2.00000
     13      -9.6828      2.00000
     14      -9.3586      2.00000
     15      -9.0792      2.00000
     16      -7.9029      2.00000
     17      -5.1928      2.00000
     18      -4.3636      2.00000
     19      -4.2439      2.00000
     20      -3.6049      2.00000
     21       0.9106      0.00000
     22       0.9932      0.00000
     23       2.0140      0.00000
     24       2.2013      0.00000
     25       2.5194      0.00000
     26       2.7830      0.00000
     27       3.0870      0.00000
     28       3.1724      0.00000

 k-point   174 :       0.2500    0.2000    0.3333
  band No.  band energies     occupation 
      1     -25.0717      2.00000
      2     -22.1392      2.00000
      3     -21.8766      2.00000
      4     -20.0245      2.00000
      5     -17.1017      2.00000
      6     -15.2723      2.00000
      7     -15.0568      2.00000
      8     -12.6336      2.00000
      9     -12.4551      2.00000
     10     -11.3696      2.00000
     11     -11.3053      2.00000
     12      -9.8959      2.00000
     13      -9.7227      2.00000
     14      -9.2146      2.00000
     15      -9.1623      2.00000
     16      -8.1116      2.00000
     17      -5.1203      2.00000
     18      -4.5602      2.00000
     19      -4.4648      2.00000
     20      -3.7697      2.00000
     21       1.1021      0.00000
     22       1.1976      0.00000
     23       2.2680      0.00000
     24       2.4431      0.00000
     25       2.7517      0.00000
     26       2.9936      0.00000
     27       3.1732      0.00000
     28       3.4158      0.00000

 k-point   175 :       0.3125    0.2000    0.3333
  band No.  band energies     occupation 
      1     -24.8341      2.00000
      2     -22.4099      2.00000
      3     -21.9370      2.00000
      4     -20.2429      2.00000
      5     -17.1367      2.00000
      6     -15.4957      2.00000
      7     -14.6351      2.00000
      8     -12.3706      2.00000
      9     -12.1864      2.00000
     10     -11.5194      2.00000
     11     -10.9435      2.00000
     12      -9.8648      2.00000
     13      -9.8566      2.00000
     14      -9.2639      2.00000
     15      -8.9909      2.00000
     16      -8.3461      2.00000
     17      -5.0150      2.00000
     18      -4.7853      2.00000
     19      -4.6979      2.00000
     20      -3.9559      2.00000
     21       1.3561      0.00000
     22       1.4688      0.00000
     23       2.5944      0.00000
     24       2.7548      0.00000
     25       2.9941      0.00000
     26       3.1035      0.00000
     27       3.2981      0.00000
     28       3.6864      0.00000

 k-point   176 :       0.3750    0.2000    0.3333
  band No.  band energies     occupation 
      1     -24.5455      2.00000
      2     -22.9177      2.00000
      3     -21.6967      2.00000
      4     -20.5155      2.00000
      5     -17.0578      2.00000
      6     -15.9118      2.00000
      7     -14.0420      2.00000
      8     -12.3202      2.00000
      9     -11.9045      2.00000
     10     -11.5023      2.00000
     11     -10.8168      2.00000
     12      -9.9240      2.00000
     13      -9.7663      2.00000
     14      -9.3085      2.00000
     15      -8.8742      2.00000
     16      -8.5783      2.00000
     17      -4.9888      2.00000
     18      -4.9112      2.00000
     19      -4.8801      2.00000
     20      -4.1513      2.00000
     21       1.6686      0.00000
     22       1.8078      0.00000
     23       2.8553      0.00000
     24       2.9985      0.00000
     25       3.1401      0.00000
     26       3.4270      0.00000
     27       3.5757      0.00000
     28       3.6546      0.00000

 k-point   177 :       0.4375    0.2000    0.3333
  band No.  band energies     occupation 
      1     -24.2073      2.00000
      2     -23.3902      2.00000
      3     -21.4239      2.00000
      4     -20.8181      2.00000
      5     -16.8785      2.00000
      6     -16.2900      2.00000
      7     -13.5070      2.00000
      8     -12.6124      2.00000
      9     -11.6062      2.00000
     10     -11.1285      2.00000
     11     -11.0083      2.00000
     12     -10.2196      2.00000
     13      -9.4315      2.00000
     14      -9.2012      2.00000
     15      -8.9116      2.00000
     16      -8.7996      2.00000
     17      -5.1199      2.00000
     18      -5.0709      2.00000
     19      -4.7200      2.00000
     20      -4.3482      2.00000
     21       2.0274      0.00000
     22       2.2099      0.00000
     23       2.7041      0.00000
     24       3.1498      0.00000
     25       3.3057      0.00000
     26       3.4724      0.00000
     27       3.5892      0.00000
     28       3.6818      0.00000

 k-point   178 :       0.5000    0.2000    0.3333
  band No.  band energies     occupation 
      1     -23.8218      2.00000
      2     -23.8209      2.00000
      3     -21.1272      2.00000
      4     -21.1266      2.00000
      5     -16.6179      2.00000
      6     -16.6161      2.00000
      7     -13.0300      2.00000
      8     -13.0282      2.00000
      9     -11.2998      2.00000
     10     -11.2985      2.00000
     11     -10.6571      2.00000
     12     -10.6559      2.00000
     13      -9.1104      2.00000
     14      -9.1090      2.00000
     15      -9.0132      2.00000
     16      -9.0118      2.00000
     17      -5.1494      2.00000
     18      -5.1454      2.00000
     19      -4.5413      2.00000
     20      -4.5391      2.00000
     21       2.4040      0.00000
     22       2.4048      0.00000
     23       2.6638      0.00000
     24       2.6652      0.00000
     25       3.3482      0.00000
     26       3.3489      0.00000
     27       4.0037      0.00000
     28       4.0039      0.00000

 k-point   179 :      -0.4375    0.2000    0.3333
  band No.  band energies     occupation 
      1     -24.2073      2.00000
      2     -23.3902      2.00000
      3     -21.4239      2.00000
      4     -20.8181      2.00000
      5     -16.8780      2.00000
      6     -16.2905      2.00000
      7     -13.5066      2.00000
      8     -12.6131      2.00000
      9     -11.6060      2.00000
     10     -11.1284      2.00000
     11     -11.0086      2.00000
     12     -10.2190      2.00000
     13      -9.4301      2.00000
     14      -9.2008      2.00000
     15      -8.9128      2.00000
     16      -8.8003      2.00000
     17      -5.1200      2.00000
     18      -5.0708      2.00000
     19      -4.7210      2.00000
     20      -4.3472      2.00000
     21       2.0272      0.00000
     22       2.2097      0.00000
     23       2.7039      0.00000
     24       3.1501      0.00000
     25       3.3061      0.00000
     26       3.4724      0.00000
     27       3.5889      0.00000
     28       3.6812      0.00000

 k-point   180 :      -0.3750    0.2000    0.3333
  band No.  band energies     occupation 
      1     -24.5455      2.00000
      2     -22.9177      2.00000
      3     -21.6967      2.00000
      4     -20.5156      2.00000
      5     -17.0573      2.00000
      6     -15.9124      2.00000
      7     -14.0418      2.00000
      8     -12.3211      2.00000
      9     -11.9044      2.00000
     10     -11.5020      2.00000
     11     -10.8170      2.00000
     12      -9.9228      2.00000
     13      -9.7649      2.00000
     14      -9.3086      2.00000
     15      -8.8752      2.00000
     16      -8.5791      2.00000
     17      -4.9889      2.00000
     18      -4.9110      2.00000
     19      -4.8812      2.00000
     20      -4.1504      2.00000
     21       1.6683      0.00000
     22       1.8077      0.00000
     23       2.8550      0.00000
     24       2.9985      0.00000
     25       3.1400      0.00000
     26       3.4266      0.00000
     27       3.5764      0.00000
     28       3.6546      0.00000

 k-point   181 :      -0.3125    0.2000    0.3333
  band No.  band energies     occupation 
      1     -24.8341      2.00000
      2     -22.4099      2.00000
      3     -21.9370      2.00000
      4     -20.2430      2.00000
      5     -17.1363      2.00000
      6     -15.4963      2.00000
      7     -14.6349      2.00000
      8     -12.3712      2.00000
      9     -12.1864      2.00000
     10     -11.5194      2.00000
     11     -10.9431      2.00000
     12      -9.8640      2.00000
     13      -9.8549      2.00000
     14      -9.2645      2.00000
     15      -8.9917      2.00000
     16      -8.3467      2.00000
     17      -5.0161      2.00000
     18      -4.7854      2.00000
     19      -4.6975      2.00000
     20      -3.9550      2.00000
     21       1.3559      0.00000
     22       1.4687      0.00000
     23       2.5943      0.00000
     24       2.7547      0.00000
     25       2.9934      0.00000
     26       3.1037      0.00000
     27       3.2978      0.00000
     28       3.6867      0.00000

 k-point   182 :      -0.2500    0.2000    0.3333
  band No.  band energies     occupation 
      1     -25.0717      2.00000
      2     -22.1392      2.00000
      3     -21.8766      2.00000
      4     -20.0246      2.00000
      5     -17.1013      2.00000
      6     -15.2722      2.00000
      7     -15.0576      2.00000
      8     -12.6339      2.00000
      9     -12.4552      2.00000
     10     -11.3684      2.00000
     11     -11.3057      2.00000
     12      -9.8943      2.00000
     13      -9.7227      2.00000
     14      -9.2151      2.00000
     15      -9.1629      2.00000
     16      -8.1121      2.00000
     17      -5.1214      2.00000
     18      -4.5605      2.00000
     19      -4.4642      2.00000
     20      -3.7690      2.00000
     21       1.1019      0.00000
     22       1.1975      0.00000
     23       2.2680      0.00000
     24       2.4431      0.00000
     25       2.7515      0.00000
     26       2.9935      0.00000
     27       3.1726      0.00000
     28       3.4162      0.00000

 k-point   183 :      -0.1875    0.2000    0.3333
  band No.  band energies     occupation 
      1     -25.2574      2.00000
      2     -22.2995      2.00000
      3     -21.3361      2.00000
      4     -19.8741      2.00000
      5     -16.9584      2.00000
      6     -15.9200      2.00000
      7     -14.6174      2.00000
      8     -12.8745      2.00000
      9     -12.7264      2.00000
     10     -11.8388      2.00000
     11     -11.1160      2.00000
     12      -9.9127      2.00000
     13      -9.6840      2.00000
     14      -9.3580      2.00000
     15      -9.0797      2.00000
     16      -7.9033      2.00000
     17      -5.1937      2.00000
     18      -4.3641      2.00000
     19      -4.2433      2.00000
     20      -3.6044      2.00000
     21       0.9104      0.00000
     22       0.9931      0.00000
     23       2.0140      0.00000
     24       2.2013      0.00000
     25       2.5193      0.00000
     26       2.7829      0.00000
     27       3.0868      0.00000
     28       3.1730      0.00000

 k-point   184 :      -0.1250    0.2000    0.3333
  band No.  band energies     occupation 
      1     -25.3904      2.00000
      2     -22.4156      2.00000
      3     -20.8246      2.00000
      4     -19.7864      2.00000
      5     -16.7488      2.00000
      6     -16.5232      2.00000
      7     -14.2090      2.00000
      8     -13.0491      2.00000
      9     -13.0138      2.00000
     10     -12.2203      2.00000
     11     -11.0056      2.00000
     12      -9.9384      2.00000
     13      -9.8902      2.00000
     14      -9.2454      2.00000
     15      -9.0111      2.00000
     16      -7.7471      2.00000
     17      -5.2344      2.00000
     18      -4.2271      2.00000
     19      -4.0598      2.00000
     20      -3.4752      2.00000
     21       0.7798      0.00000
     22       0.8509      0.00000
     23       1.8327      0.00000
     24       2.0290      0.00000
     25       2.3534      0.00000
     26       2.6359      0.00000
     27       2.8805      0.00000
     28       2.9823      0.00000

 k-point   185 :      -0.0625    0.2000    0.3333
  band No.  band energies     occupation 
      1     -25.4705      2.00000
      2     -22.4858      2.00000
      3     -20.4193      2.00000
      4     -19.7443      2.00000
      5     -16.9897      2.00000
      6     -16.5525      2.00000
      7     -13.8909      2.00000
      8     -13.2708      2.00000
      9     -13.1533      2.00000
     10     -12.4628      2.00000
     11     -10.9593      2.00000
     12     -10.1724      2.00000
     13      -9.8567      2.00000
     14      -9.1417      2.00000
     15      -8.9571      2.00000
     16      -7.6550      2.00000
     17      -5.2515      2.00000
     18      -4.1525      2.00000
     19      -3.9371      2.00000
     20      -3.3930      2.00000
     21       0.7052      0.00000
     22       0.7666      0.00000
     23       1.7241      0.00000
     24       1.9257      0.00000
     25       2.2543      0.00000
     26       2.5491      0.00000
     27       2.6981      0.00000
     28       2.8580      0.00000

 k-point   186 :       0.0000    0.2667    0.3333
  band No.  band energies     occupation 
      1     -25.3279      2.00000
      2     -22.9675      2.00000
      3     -20.1267      2.00000
      4     -19.4868      2.00000
      5     -17.1216      2.00000
      6     -16.7502      2.00000
      7     -13.5491      2.00000
      8     -13.4700      2.00000
      9     -13.2955      2.00000
     10     -12.3423      2.00000
     11     -10.9884      2.00000
     12      -9.9455      2.00000
     13      -9.8525      2.00000
     14      -9.1994      2.00000
     15      -8.9446      2.00000
     16      -7.6224      2.00000
     17      -5.3040      2.00000
     18      -4.1927      2.00000
     19      -4.0438      2.00000
     20      -3.5097      2.00000
     21       0.8497      0.00000
     22       0.8961      0.00000
     23       1.9355      0.00000
     24       2.1149      0.00000
     25       2.4295      0.00000
     26       2.6544      0.00000
     27       2.7244      0.00000
     28       3.0266      0.00000

 k-point   187 :       0.0625    0.2667    0.3333
  band No.  band energies     occupation 
      1     -25.3013      2.00000
      2     -22.9432      2.00000
      3     -20.2888      2.00000
      4     -19.5219      2.00000
      5     -16.9454      2.00000
      6     -16.8039      2.00000
      7     -13.4527      2.00000
      8     -13.4271      2.00000
      9     -13.3961      2.00000
     10     -12.2741      2.00000
     11     -11.0255      2.00000
     12      -9.8679      2.00000
     13      -9.8589      2.00000
     14      -9.2019      2.00000
     15      -8.9701      2.00000
     16      -7.6452      2.00000
     17      -5.3068      2.00000
     18      -4.2138      2.00000
     19      -4.0866      2.00000
     20      -3.5402      2.00000
     21       0.8750      0.00000
     22       0.9231      0.00000
     23       1.9717      0.00000
     24       2.1485      0.00000
     25       2.4618      0.00000
     26       2.6855      0.00000
     27       2.7847      0.00000
     28       3.0380      0.00000

 k-point   188 :       0.1250    0.2667    0.3333
  band No.  band energies     occupation 
      1     -25.2216      2.00000
      2     -22.8704      2.00000
      3     -20.6883      2.00000
      4     -19.6321      2.00000
      5     -16.9191      2.00000
      6     -16.5079      2.00000
      7     -13.7506      2.00000
      8     -13.2967      2.00000
      9     -13.0876      2.00000
     10     -12.1072      2.00000
     11     -11.1443      2.00000
     12      -9.8640      2.00000
     13      -9.6799      2.00000
     14      -9.2056      2.00000
     15      -9.0353      2.00000
     16      -7.7217      2.00000
     17      -5.3093      2.00000
     18      -4.2812      2.00000
     19      -4.2078      2.00000
     20      -3.6286      2.00000
     21       0.9529      0.00000
     22       1.0037      0.00000
     23       2.0802      0.00000
     24       2.2488      0.00000
     25       2.5578      0.00000
     26       2.7742      0.00000
     27       2.9426      0.00000
     28       3.0683      0.00000

 k-point   189 :       0.1875    0.2667    0.3333
  band No.  band energies     occupation 
      1     -25.0891      2.00000
      2     -22.7498      2.00000
      3     -21.1935      2.00000
      4     -19.8250      2.00000
      5     -17.0113      2.00000
      6     -15.9518      2.00000
      7     -14.1594      2.00000
      8     -13.0757      2.00000
      9     -12.6645      2.00000
     10     -11.8574      2.00000
     11     -11.3517      2.00000
     12      -9.8413      2.00000
     13      -9.5196      2.00000
     14      -9.2080      2.00000
     15      -9.0726      2.00000
     16      -7.8650      2.00000
     17      -5.2968      2.00000
     18      -4.4066      2.00000
     19      -4.3866      2.00000
     20      -3.7660      2.00000
     21       1.0879      0.00000
     22       1.1383      0.00000
     23       2.2609      0.00000
     24       2.4145      0.00000
     25       2.7152      0.00000
     26       2.9172      0.00000
     27       3.1024      0.00000
     28       3.1481      0.00000

 k-point   190 :       0.2500    0.2667    0.3333
  band No.  band energies     occupation 
      1     -24.9041      2.00000
      2     -22.5825      2.00000
      3     -21.7286      2.00000
      4     -20.0961      2.00000
      5     -17.0245      2.00000
      6     -15.3693      2.00000
      7     -14.6024      2.00000
      8     -12.7697      2.00000
      9     -12.2610      2.00000
     10     -11.6248      2.00000
     11     -11.4970      2.00000
     12      -9.7830      2.00000
     13      -9.5695      2.00000
     14      -9.2180      2.00000
     15      -8.9603      2.00000
     16      -8.0753      2.00000
     17      -5.2569      2.00000
     18      -4.6106      2.00000
     19      -4.5785      2.00000
     20      -3.9392      2.00000
     21       1.2838      0.00000
     22       1.3307      0.00000
     23       2.5134      0.00000
     24       2.6450      0.00000
     25       2.9312      0.00000
     26       3.0818      0.00000
     27       3.1550      0.00000
     28       3.3204      0.00000

 k-point   191 :       0.3125    0.2667    0.3333
  band No.  band energies     occupation 
      1     -24.6675      2.00000
      2     -22.3703      2.00000
      3     -22.2573      2.00000
      4     -20.4245      2.00000
      5     -16.9433      2.00000
      6     -15.0477      2.00000
      7     -14.8098      2.00000
      8     -12.4711      2.00000
      9     -11.9229      2.00000
     10     -11.8470      2.00000
     11     -11.0661      2.00000
     12      -9.7229      2.00000
     13      -9.7214      2.00000
     14      -9.2454      2.00000
     15      -8.8254      2.00000
     16      -8.3295      2.00000
     17      -5.1836      2.00000
     18      -4.8330      2.00000
     19      -4.7943      2.00000
     20      -4.1341      2.00000
     21       1.5410      0.00000
     22       1.5869      0.00000
     23       2.8348      0.00000
     24       2.9301      0.00000
     25       2.9707      0.00000
     26       3.2332      0.00000
     27       3.4203      0.00000
     28       3.5738      0.00000

 k-point   192 :       0.3750    0.2667    0.3333
  band No.  band energies     occupation 
      1     -24.3802      2.00000
      2     -22.7614      2.00000
      3     -22.1158      2.00000
      4     -20.7826      2.00000
      5     -16.7750      2.00000
      6     -15.4756      2.00000
      7     -14.2931      2.00000
      8     -12.5818      2.00000
      9     -11.6185      2.00000
     10     -11.6104      2.00000
     11     -10.7632      2.00000
     12      -9.7789      2.00000
     13      -9.7623      2.00000
     14      -9.2413      2.00000
     15      -8.7961      2.00000
     16      -8.5808      2.00000
     17      -5.0748      2.00000
     18      -5.0305      2.00000
     19      -5.0008      2.00000
     20      -4.3399      2.00000
     21       1.8540      0.00000
     22       1.9101      0.00000
     23       2.8511      0.00000
     24       3.2297      0.00000
     25       3.3088      0.00000
     26       3.5261      0.00000
     27       3.6609      0.00000
     28       3.8077      0.00000

 k-point   193 :       0.4375    0.2667    0.3333
  band No.  band energies     occupation 
      1     -24.0436      2.00000
      2     -23.2309      2.00000
      3     -21.8227      2.00000
      4     -21.1459      2.00000
      5     -16.5326      2.00000
      6     -15.8726      2.00000
      7     -13.8169      2.00000
      8     -12.9506      2.00000
      9     -11.3223      2.00000
     10     -11.0910      2.00000
     11     -10.8024      2.00000
     12     -10.0759      2.00000
     13      -9.5186      2.00000
     14      -9.1355      2.00000
     15      -8.9149      2.00000
     16      -8.7933      2.00000
     17      -5.1674      2.00000
     18      -5.1495      2.00000
     19      -4.9288      2.00000
     20      -4.5488      2.00000
     21       2.2108      0.00000
     22       2.2956      0.00000
     23       2.8142      0.00000
     24       3.1795      0.00000
     25       3.4445      0.00000
     26       3.6912      0.00000
     27       3.7629      0.00000
     28       3.8717      0.00000

 k-point   194 :       0.5000    0.2667    0.3333
  band No.  band energies     occupation 
      1     -23.6600      2.00000
      2     -23.6592      2.00000
      3     -21.4968      2.00000
      4     -21.4966      2.00000
      5     -16.2289      2.00000
      6     -16.2277      2.00000
      7     -13.3714      2.00000
      8     -13.3699      2.00000
      9     -11.0375      2.00000
     10     -11.0361      2.00000
     11     -10.5472      2.00000
     12     -10.5460      2.00000
     13      -9.1774      2.00000
     14      -9.1759      2.00000
     15      -8.9759      2.00000
     16      -8.9747      2.00000
     17      -5.2118      2.00000
     18      -5.2081      2.00000
     19      -4.7506      2.00000
     20      -4.7488      2.00000
     21       2.5807      0.00000
     22       2.5820      0.00000
     23       2.7292      0.00000
     24       2.7302      0.00000
     25       3.4885      0.00000
     26       3.4892      0.00000
     27       4.1324      0.00000
     28       4.1332      0.00000

 k-point   195 :      -0.4375    0.2667    0.3333
  band No.  band energies     occupation 
      1     -24.0436      2.00000
      2     -23.2309      2.00000
      3     -21.8227      2.00000
      4     -21.1460      2.00000
      5     -16.5322      2.00000
      6     -15.8731      2.00000
      7     -13.8166      2.00000
      8     -12.9510      2.00000
      9     -11.3222      2.00000
     10     -11.0911      2.00000
     11     -10.8026      2.00000
     12     -10.0753      2.00000
     13      -9.5172      2.00000
     14      -9.1351      2.00000
     15      -8.9161      2.00000
     16      -8.7940      2.00000
     17      -5.1650      2.00000
     18      -5.1518      2.00000
     19      -4.9300      2.00000
     20      -4.5477      2.00000
     21       2.2106      0.00000
     22       2.2955      0.00000
     23       2.8140      0.00000
     24       3.1798      0.00000
     25       3.4448      0.00000
     26       3.6911      0.00000
     27       3.7627      0.00000
     28       3.8713      0.00000

 k-point   196 :      -0.3750    0.2667    0.3333
  band No.  band energies     occupation 
      1     -24.3802      2.00000
      2     -22.7614      2.00000
      3     -22.1157      2.00000
      4     -20.7826      2.00000
      5     -16.7746      2.00000
      6     -15.4762      2.00000
      7     -14.2929      2.00000
      8     -12.5825      2.00000
      9     -11.6186      2.00000
     10     -11.6102      2.00000
     11     -10.7630      2.00000
     12      -9.7777      2.00000
     13      -9.7612      2.00000
     14      -9.2417      2.00000
     15      -8.7971      2.00000
     16      -8.5816      2.00000
     17      -5.0761      2.00000
     18      -5.0281      2.00000
     19      -5.0029      2.00000
     20      -4.3389      2.00000
     21       1.8537      0.00000
     22       1.9100      0.00000
     23       2.8509      0.00000
     24       3.2296      0.00000
     25       3.3086      0.00000
     26       3.5263      0.00000
     27       3.6611      0.00000
     28       3.8075      0.00000

 k-point   197 :      -0.3125    0.2667    0.3333
  band No.  band energies     occupation 
      1     -24.6675      2.00000
      2     -22.3703      2.00000
      3     -22.2573      2.00000
      4     -20.4246      2.00000
      5     -16.9429      2.00000
      6     -15.0483      2.00000
      7     -14.8097      2.00000
      8     -12.4719      2.00000
      9     -11.9232      2.00000
     10     -11.8467      2.00000
     11     -11.0649      2.00000
     12      -9.7222      2.00000
     13      -9.7199      2.00000
     14      -9.2464      2.00000
     15      -8.8261      2.00000
     16      -8.3301      2.00000
     17      -5.1849      2.00000
     18      -4.8311      2.00000
     19      -4.7958      2.00000
     20      -4.1331      2.00000
     21       1.5407      0.00000
     22       1.5868      0.00000
     23       2.8347      0.00000
     24       2.9302      0.00000
     25       2.9702      0.00000
     26       3.2333      0.00000
     27       3.4203      0.00000
     28       3.5732      0.00000

 k-point   198 :      -0.2500    0.2667    0.3333
  band No.  band energies     occupation 
      1     -24.9041      2.00000
      2     -22.5825      2.00000
      3     -21.7286      2.00000
      4     -20.0962      2.00000
      5     -17.0242      2.00000
      6     -15.3692      2.00000
      7     -14.6031      2.00000
      8     -12.7701      2.00000
      9     -12.2617      2.00000
     10     -11.6251      2.00000
     11     -11.4951      2.00000
     12      -9.7811      2.00000
     13      -9.5698      2.00000
     14      -9.2190      2.00000
     15      -8.9606      2.00000
     16      -8.0758      2.00000
     17      -5.2582      2.00000
     18      -4.6093      2.00000
     19      -4.5795      2.00000
     20      -3.9383      2.00000
     21       1.2836      0.00000
     22       1.3306      0.00000
     23       2.5134      0.00000
     24       2.6449      0.00000
     25       2.9310      0.00000
     26       3.0818      0.00000
     27       3.1549      0.00000
     28       3.3198      0.00000

 k-point   199 :      -0.1875    0.2667    0.3333
  band No.  band energies     occupation 
      1     -25.0891      2.00000
      2     -22.7498      2.00000
      3     -21.1935      2.00000
      4     -19.8251      2.00000
      5     -17.0110      2.00000
      6     -15.9518      2.00000
      7     -14.1603      2.00000
      8     -13.0758      2.00000
      9     -12.6652      2.00000
     10     -11.8551      2.00000
     11     -11.3521      2.00000
     12      -9.8395      2.00000
     13      -9.5207      2.00000
     14      -9.2090      2.00000
     15      -9.0720      2.00000
     16      -7.8653      2.00000
     17      -5.2979      2.00000
     18      -4.4068      2.00000
     19      -4.3862      2.00000
     20      -3.7653      2.00000
     21       1.0876      0.00000
     22       1.1383      0.00000
     23       2.2609      0.00000
     24       2.4144      0.00000
     25       2.7151      0.00000
     26       2.9172      0.00000
     27       3.1022      0.00000
     28       3.1480      0.00000

 k-point   200 :      -0.1250    0.2667    0.3333
  band No.  band energies     occupation 
      1     -25.2216      2.00000
      2     -22.8704      2.00000
      3     -20.6882      2.00000
      4     -19.6322      2.00000
      5     -16.9189      2.00000
      6     -16.5079      2.00000
      7     -13.7517      2.00000
      8     -13.2968      2.00000
      9     -13.0881      2.00000
     10     -12.1051      2.00000
     11     -11.1448      2.00000
     12      -9.8624      2.00000
     13      -9.6809      2.00000
     14      -9.2065      2.00000
     15      -9.0347      2.00000
     16      -7.7219      2.00000
     17      -5.3100      2.00000
     18      -4.2816      2.00000
     19      -4.2073      2.00000
     20      -3.6281      2.00000
     21       0.9527      0.00000
     22       1.0036      0.00000
     23       2.0802      0.00000
     24       2.2487      0.00000
     25       2.5578      0.00000
     26       2.7740      0.00000
     27       2.9430      0.00000
     28       3.0685      0.00000

 k-point   201 :      -0.0625    0.2667    0.3333
  band No.  band energies     occupation 
      1     -25.3013      2.00000
      2     -22.9432      2.00000
      3     -20.2888      2.00000
      4     -19.5219      2.00000
      5     -16.9454      2.00000
      6     -16.8037      2.00000
      7     -13.4540      2.00000
      8     -13.4271      2.00000
      9     -13.3960      2.00000
     10     -12.2727      2.00000
     11     -11.0258      2.00000
     12      -9.8685      2.00000
     13      -9.8581      2.00000
     14      -9.2024      2.00000
     15      -8.9697      2.00000
     16      -7.6453      2.00000
     17      -5.3072      2.00000
     18      -4.2140      2.00000
     19      -4.0863      2.00000
     20      -3.5400      2.00000
     21       0.8749      0.00000
     22       0.9231      0.00000
     23       1.9717      0.00000
     24       2.1485      0.00000
     25       2.4618      0.00000
     26       2.6853      0.00000
     27       2.7850      0.00000
     28       3.0383      0.00000

 k-point   202 :       0.0000    0.3333    0.3333
  band No.  band energies     occupation 
      1     -25.1122      2.00000
      2     -23.4080      2.00000
      3     -19.9708      2.00000
      4     -19.3577      2.00000
      5     -17.0710      2.00000
      6     -16.9341      2.00000
      7     -13.7526      2.00000
      8     -13.7235      2.00000
      9     -12.8450      2.00000
     10     -11.9866      2.00000
     11     -11.1158      2.00000
     12      -9.9534      2.00000
     13      -9.7006      2.00000
     14      -9.4268      2.00000
     15      -8.7336      2.00000
     16      -7.6636      2.00000
     17      -5.2952      2.00000
     18      -4.3159      2.00000
     19      -4.1750      2.00000
     20      -3.6785      2.00000
     21       1.0766      0.00000
     22       1.1252      0.00000
     23       2.2535      0.00000
     24       2.3968      0.00000
     25       2.6722      0.00000
     26       2.7797      0.00000
     27       2.8852      0.00000
     28       3.1527      0.00000

 k-point   203 :       0.0625    0.3333    0.3333
  band No.  band energies     occupation 
      1     -25.0857      2.00000
      2     -23.3830      2.00000
      3     -20.1287      2.00000
      4     -19.4241      2.00000
      5     -16.9473      2.00000
      6     -16.9101      2.00000
      7     -13.6692      2.00000
      8     -13.6254      2.00000
      9     -12.9776      2.00000
     10     -11.9223      2.00000
     11     -11.1820      2.00000
     12      -9.9415      2.00000
     13      -9.6421      2.00000
     14      -9.4162      2.00000
     15      -8.7427      2.00000
     16      -7.6783      2.00000
     17      -5.3061      2.00000
     18      -4.3428      2.00000
     19      -4.2105      2.00000
     20      -3.7108      2.00000
     21       1.1031      0.00000
     22       1.1515      0.00000
     23       2.2895      0.00000
     24       2.4291      0.00000
     25       2.7047      0.00000
     26       2.8250      0.00000
     27       2.9169      0.00000
     28       3.1413      0.00000

 k-point   204 :       0.1250    0.3333    0.3333
  band No.  band energies     occupation 
      1     -25.0064      2.00000
      2     -23.3083      2.00000
      3     -20.5191      2.00000
      4     -19.6171      2.00000
      5     -16.9600      2.00000
      6     -16.5153      2.00000
      7     -13.5042      2.00000
      8     -13.3052      2.00000
      9     -13.2726      2.00000
     10     -11.7787      2.00000
     11     -11.3710      2.00000
     12      -9.9025      2.00000
     13      -9.5094      2.00000
     14      -9.3868      2.00000
     15      -8.7617      2.00000
     16      -7.7342      2.00000
     17      -5.3318      2.00000
     18      -4.4302      2.00000
     19      -4.3054      2.00000
     20      -3.8036      2.00000
     21       1.1842      0.00000
     22       1.2297      0.00000
     23       2.3973      0.00000
     24       2.5247      0.00000
     25       2.7975      0.00000
     26       2.9382      0.00000
     27       3.0004      0.00000
     28       3.1233      0.00000

 k-point   205 :       0.1875    0.3333    0.3333
  band No.  band energies     occupation 
      1     -24.8745      2.00000
      2     -23.1843      2.00000
      3     -21.0151      2.00000
      4     -19.9148      2.00000
      5     -16.9280      2.00000
      6     -16.0247      2.00000
      7     -13.7061      2.00000
      8     -13.2255      2.00000
      9     -12.7961      2.00000
     10     -11.6538      2.00000
     11     -11.5940      2.00000
     12      -9.8357      2.00000
     13      -9.4061      2.00000
     14      -9.3437      2.00000
     15      -8.7595      2.00000
     16      -7.8548      2.00000
     17      -5.3544      2.00000
     18      -4.5841      2.00000
     19      -4.4408      2.00000
     20      -3.9464      2.00000
     21       1.3236      0.00000
     22       1.3585      0.00000
     23       2.5754      0.00000
     24       2.6782      0.00000
     25       2.9311      0.00000
     26       3.0383      0.00000
     27       3.0801      0.00000
     28       3.2116      0.00000

 k-point   206 :       0.2500    0.3333    0.3333
  band No.  band energies     occupation 
      1     -24.6906      2.00000
      2     -23.0120      2.00000
      3     -21.5423      2.00000
      4     -20.2831      2.00000
      5     -16.8294      2.00000
      6     -15.5232      2.00000
      7     -14.1493      2.00000
      8     -12.8509      2.00000
      9     -12.2581      2.00000
     10     -11.9787      2.00000
     11     -11.3610      2.00000
     12      -9.7521      2.00000
     13      -9.4233      2.00000
     14      -9.2957      2.00000
     15      -8.7126      2.00000
     16      -8.0531      2.00000
     17      -5.3570      2.00000
     18      -4.7820      2.00000
     19      -4.6162      2.00000
     20      -4.1251      2.00000
     21       1.5236      0.00000
     22       1.5399      0.00000
     23       2.8137      0.00000
     24       2.8837      0.00000
     25       2.9978      0.00000
     26       3.0905      0.00000
     27       3.2536      0.00000
     28       3.4328      0.00000

 k-point   207 :       0.3125    0.3333    0.3333
  band No.  band energies     occupation 
      1     -24.4553      2.00000
      2     -22.7927      2.00000
      3     -22.0645      2.00000
      4     -20.6871      2.00000
      5     -16.6626      2.00000
      6     -15.0466      2.00000
      7     -14.5979      2.00000
      8     -12.6228      2.00000
      9     -12.0886      2.00000
     10     -11.7522      2.00000
     11     -11.0615      2.00000
     12      -9.6855      2.00000
     13      -9.5371      2.00000
     14      -9.2495      2.00000
     15      -8.6807      2.00000
     16      -8.3168      2.00000
     17      -5.3277      2.00000
     18      -4.9862      2.00000
     19      -4.8263      2.00000
     20      -4.3264      2.00000
     21       1.7814      0.00000
     22       1.7827      0.00000
     23       2.8862      0.00000
     24       3.0828      0.00000
     25       3.1846      0.00000
     26       3.3380      0.00000
     27       3.5354      0.00000
     28       3.7287      0.00000

 k-point   208 :       0.3750    0.3333    0.3333
  band No.  band energies     occupation 
      1     -24.1697      2.00000
      2     -22.5634      2.00000
      3     -22.5284      2.00000
      4     -21.0991      2.00000
      5     -16.4337      2.00000
      6     -15.0331      2.00000
      7     -14.5988      2.00000
      8     -12.9258      2.00000
      9     -11.6122      2.00000
     10     -11.3422      2.00000
     11     -10.7392      2.00000
     12      -9.7229      2.00000
     13      -9.6377      2.00000
     14      -9.1915      2.00000
     15      -8.7434      2.00000
     16      -8.5959      2.00000
     17      -5.2565      2.00000
     18      -5.1603      2.00000
     19      -5.0386      2.00000
     20      -4.5411      2.00000
     21       2.0899      0.00000
     22       2.0941      0.00000
     23       2.8690      0.00000
     24       3.3739      0.00000
     25       3.5668      0.00000
     26       3.6403      0.00000
     27       3.8348      0.00000
     28       3.9632      0.00000

 k-point   209 :       0.4375    0.3333    0.3333
  band No.  band energies     occupation 
      1     -23.8353      2.00000
      2     -23.0287      2.00000
      3     -22.2219      2.00000
      4     -21.5000      2.00000
      5     -16.1497      2.00000
      6     -15.4424      2.00000
      7     -14.1696      2.00000
      8     -13.3305      2.00000
      9     -11.0163      2.00000
     10     -11.0150      2.00000
     11     -10.6103      2.00000
     12      -9.9778      2.00000
     13      -9.5399      2.00000
     14      -9.0964      2.00000
     15      -8.9352      2.00000
     16      -8.8174      2.00000
     17      -5.2703      2.00000
     18      -5.2055      2.00000
     19      -5.1346      2.00000
     20      -4.7593      2.00000
     21       2.4474      0.00000
     22       2.4613      0.00000
     23       2.9584      0.00000
     24       3.2836      0.00000
     25       3.6092      0.00000
     26       3.8867      0.00000
     27       4.0246      0.00000
     28       4.0880      0.00000

 k-point   210 :       0.5000    0.3333    0.3333
  band No.  band energies     occupation 
      1     -23.4544      2.00000
      2     -23.4536      2.00000
      3     -21.8772      2.00000
      4     -21.8771      2.00000
      5     -15.8175      2.00000
      6     -15.8167      2.00000
      7     -13.7488      2.00000
      8     -13.7476      2.00000
      9     -10.7540      2.00000
     10     -10.7525      2.00000
     11     -10.4412      2.00000
     12     -10.4401      2.00000
     13      -9.2367      2.00000
     14      -9.2350      2.00000
     15      -8.9729      2.00000
     16      -8.9717      2.00000
     17      -5.2899      2.00000
     18      -5.2867      2.00000
     19      -4.9648      2.00000
     20      -4.9633      2.00000
     21       2.8113      0.00000
     22       2.8130      0.00000
     23       2.8765      0.00000
     24       2.8770      0.00000
     25       3.6409      0.00000
     26       3.6414      0.00000
     27       4.2084      0.00000
     28       4.2096      0.00000

 k-point   211 :      -0.4375    0.3333    0.3333
  band No.  band energies     occupation 
      1     -23.8353      2.00000
      2     -23.0287      2.00000
      3     -22.2219      2.00000
      4     -21.5001      2.00000
      5     -16.1494      2.00000
      6     -15.4428      2.00000
      7     -14.1695      2.00000
      8     -13.3307      2.00000
      9     -11.0166      2.00000
     10     -11.0151      2.00000
     11     -10.6098      2.00000
     12      -9.9774      2.00000
     13      -9.5386      2.00000
     14      -9.0960      2.00000
     15      -8.9363      2.00000
     16      -8.8182      2.00000
     17      -5.2684      2.00000
     18      -5.2073      2.00000
     19      -5.1359      2.00000
     20      -4.7581      2.00000
     21       2.4473      0.00000
     22       2.4612      0.00000
     23       2.9581      0.00000
     24       3.2838      0.00000
     25       3.6092      0.00000
     26       3.8867      0.00000
     27       4.0250      0.00000
     28       4.0875      0.00000

 k-point   212 :      -0.3750    0.3333    0.3333
  band No.  band energies     occupation 
      1     -24.1697      2.00000
      2     -22.5634      2.00000
      3     -22.5284      2.00000
      4     -21.0991      2.00000
      5     -16.4334      2.00000
      6     -15.0335      2.00000
      7     -14.5987      2.00000
      8     -12.9262      2.00000
      9     -11.6121      2.00000
     10     -11.3429      2.00000
     11     -10.7379      2.00000
     12      -9.7220      2.00000
     13      -9.6370      2.00000
     14      -9.1917      2.00000
     15      -8.7443      2.00000
     16      -8.5966      2.00000
     17      -5.2579      2.00000
     18      -5.1585      2.00000
     19      -5.0401      2.00000
     20      -4.5399      2.00000
     21       2.0899      0.00000
     22       2.0939      0.00000
     23       2.8688      0.00000
     24       3.3739      0.00000
     25       3.5668      0.00000
     26       3.6402      0.00000
     27       3.8344      0.00000
     28       3.9634      0.00000

 k-point   213 :      -0.3125    0.3333    0.3333
  band No.  band energies     occupation 
      1     -24.4553      2.00000
      2     -22.7927      2.00000
      3     -22.0645      2.00000
      4     -20.6871      2.00000
      5     -16.6623      2.00000
      6     -15.0465      2.00000
      7     -14.5984      2.00000
      8     -12.6235      2.00000
      9     -12.0882      2.00000
     10     -11.7531      2.00000
     11     -11.0596      2.00000
     12      -9.6842      2.00000
     13      -9.5370      2.00000
     14      -9.2502      2.00000
     15      -8.6812      2.00000
     16      -8.3173      2.00000
     17      -5.3291      2.00000
     18      -4.9847      2.00000
     19      -4.8275      2.00000
     20      -4.3254      2.00000
     21       1.7814      0.00000
     22       1.7825      0.00000
     23       2.8860      0.00000
     24       3.0829      0.00000
     25       3.1846      0.00000
     26       3.3376      0.00000
     27       3.5346      0.00000
     28       3.7283      0.00000

 k-point   214 :      -0.2500    0.3333    0.3333
  band No.  band energies     occupation 
      1     -24.6906      2.00000
      2     -23.0120      2.00000
      3     -21.5423      2.00000
      4     -20.2832      2.00000
      5     -16.8291      2.00000
      6     -15.5232      2.00000
      7     -14.1500      2.00000
      8     -12.8512      2.00000
      9     -12.2589      2.00000
     10     -11.9787      2.00000
     11     -11.3589      2.00000
     12      -9.7506      2.00000
     13      -9.4237      2.00000
     14      -9.2968      2.00000
     15      -8.7126      2.00000
     16      -8.0535      2.00000
     17      -5.3584      2.00000
     18      -4.7807      2.00000
     19      -4.6172      2.00000
     20      -4.1242      2.00000
     21       1.5233      0.00000
     22       1.5399      0.00000
     23       2.8137      0.00000
     24       2.8839      0.00000
     25       2.9973      0.00000
     26       3.0907      0.00000
     27       3.2527      0.00000
     28       3.4323      0.00000

 k-point   215 :      -0.1875    0.3333    0.3333
  band No.  band energies     occupation 
      1     -24.8745      2.00000
      2     -23.1843      2.00000
      3     -21.0151      2.00000
      4     -19.9149      2.00000
      5     -16.9278      2.00000
      6     -16.0247      2.00000
      7     -13.7069      2.00000
      8     -13.2257      2.00000
      9     -12.7967      2.00000
     10     -11.6540      2.00000
     11     -11.5920      2.00000
     12      -9.8341      2.00000
     13      -9.4071      2.00000
     14      -9.3449      2.00000
     15      -8.7590      2.00000
     16      -7.8550      2.00000
     17      -5.3556      2.00000
     18      -4.5832      2.00000
     19      -4.4415      2.00000
     20      -3.9457      2.00000
     21       1.3233      0.00000
     22       1.3585      0.00000
     23       2.5754      0.00000
     24       2.6782      0.00000
     25       2.9315      0.00000
     26       3.0378      0.00000
     27       3.0799      0.00000
     28       3.2110      0.00000

 k-point   216 :      -0.1250    0.3333    0.3333
  band No.  band energies     occupation 
      1     -25.0064      2.00000
      2     -23.3083      2.00000
      3     -20.5191      2.00000
      4     -19.6171      2.00000
      5     -16.9598      2.00000
      6     -16.5153      2.00000
      7     -13.5043      2.00000
      8     -13.3058      2.00000
      9     -13.2733      2.00000
     10     -11.7768      2.00000
     11     -11.3713      2.00000
     12      -9.9010      2.00000
     13      -9.5104      2.00000
     14      -9.3878      2.00000
     15      -8.7611      2.00000
     16      -7.7344      2.00000
     17      -5.3326      2.00000
     18      -4.4297      2.00000
     19      -4.3058      2.00000
     20      -3.8031      2.00000
     21       1.1841      0.00000
     22       1.2297      0.00000
     23       2.3973      0.00000
     24       2.5247      0.00000
     25       2.7977      0.00000
     26       2.9376      0.00000
     27       3.0011      0.00000
     28       3.1229      0.00000

 k-point   217 :      -0.0625    0.3333    0.3333
  band No.  band energies     occupation 
      1     -25.0857      2.00000
      2     -23.3830      2.00000
      3     -20.1287      2.00000
      4     -19.4242      2.00000
      5     -16.9471      2.00000
      6     -16.9101      2.00000
      7     -13.6693      2.00000
      8     -13.6255      2.00000
      9     -12.9785      2.00000
     10     -11.9209      2.00000
     11     -11.1823      2.00000
     12      -9.9407      2.00000
     13      -9.6428      2.00000
     14      -9.4169      2.00000
     15      -8.7424      2.00000
     16      -7.6784      2.00000
     17      -5.3066      2.00000
     18      -4.3427      2.00000
     19      -4.2106      2.00000
     20      -3.7105      2.00000
     21       1.1030      0.00000
     22       1.1515      0.00000
     23       2.2895      0.00000
     24       2.4291      0.00000
     25       2.7048      0.00000
     26       2.8247      0.00000
     27       2.9171      0.00000
     28       3.1414      0.00000

 k-point   218 :       0.0000    0.4000    0.3333
  band No.  band energies     occupation 
      1     -24.8514      2.00000
      2     -23.8219      2.00000
      3     -19.7954      2.00000
      4     -19.3557      2.00000
      5     -17.0371      2.00000
      6     -17.0172      2.00000
      7     -13.9226      2.00000
      8     -13.9145      2.00000
      9     -12.4074      2.00000
     10     -11.5609      2.00000
     11     -11.3365      2.00000
     12     -10.2364      2.00000
     13      -9.5581      2.00000
     14      -9.5125      2.00000
     15      -8.4760      2.00000
     16      -7.7724      2.00000
     17      -5.2064      2.00000
     18      -4.5492      2.00000
     19      -4.1914      2.00000
     20      -3.8538      2.00000
     21       1.3578      0.00000
     22       1.4279      0.00000
     23       2.5329      0.00000
     24       2.6430      0.00000
     25       2.7011      0.00000
     26       2.8774      0.00000
     27       3.1457      0.00000
     28       3.3062      0.00000

 k-point   219 :       0.0625    0.4000    0.3333
  band No.  band energies     occupation 
      1     -24.8251      2.00000
      2     -23.7965      2.00000
      3     -19.9468      2.00000
      4     -19.4546      2.00000
      5     -16.9850      2.00000
      6     -16.8980      2.00000
      7     -13.8453      2.00000
      8     -13.8041      2.00000
      9     -12.5386      2.00000
     10     -11.4975      2.00000
     11     -11.4290      2.00000
     12     -10.2010      2.00000
     13      -9.5174      2.00000
     14      -9.4970      2.00000
     15      -8.4725      2.00000
     16      -7.7780      2.00000
     17      -5.2253      2.00000
     18      -4.5802      2.00000
     19      -4.2223      2.00000
     20      -3.8869      2.00000
     21       1.3855      0.00000
     22       1.4545      0.00000
     23       2.5590      0.00000
     24       2.6790      0.00000
     25       2.7348      0.00000
     26       2.9071      0.00000
     27       3.1705      0.00000
     28       3.3209      0.00000

 k-point   220 :       0.1250    0.4000    0.3333
  band No.  band energies     occupation 
      1     -24.7463      2.00000
      2     -23.7203      2.00000
      3     -20.3235      2.00000
      4     -19.7225      2.00000
      5     -16.8940      2.00000
      6     -16.5611      2.00000
      7     -13.6370      2.00000
      8     -13.4755      2.00000
      9     -12.8520      2.00000
     10     -11.6727      2.00000
     11     -11.3610      2.00000
     12     -10.1154      2.00000
     13      -9.4537      2.00000
     14      -9.4245      2.00000
     15      -8.4644      2.00000
     16      -7.8093      2.00000
     17      -5.2744      2.00000
     18      -4.6713      2.00000
     19      -4.3095      2.00000
     20      -3.9813      2.00000
     21       1.4696      0.00000
     22       1.5329      0.00000
     23       2.6347      0.00000
     24       2.7809      0.00000
     25       2.8242      0.00000
     26       2.9870      0.00000
     27       3.2091      0.00000
     28       3.3417      0.00000

 k-point   221 :       0.1875    0.4000    0.3333
  band No.  band energies     occupation 
      1     -24.6153      2.00000
      2     -23.5939      2.00000
      3     -20.8059      2.00000
      4     -20.1000      2.00000
      5     -16.7533      2.00000
      6     -16.1508      2.00000
      7     -13.2945      2.00000
      8     -13.2739      2.00000
      9     -12.9720      2.00000
     10     -12.0061      2.00000
     11     -11.1973      2.00000
     12     -10.0088      2.00000
     13      -9.3891      2.00000
     14      -9.3415      2.00000
     15      -8.4612      2.00000
     16      -7.8979      2.00000
     17      -5.3351      2.00000
     18      -4.8146      2.00000
     19      -4.4424      2.00000
     20      -4.1257      2.00000
     21       1.6128      0.00000
     22       1.6596      0.00000
     23       2.7465      0.00000
     24       2.8753      0.00000
     25       2.9760      0.00000
     26       3.0612      0.00000
     27       3.2618      0.00000
     28       3.4606      0.00000

 k-point   222 :       0.2500    0.4000    0.3333
  band No.  band energies     occupation 
      1     -24.4327      2.00000
      2     -23.4179      2.00000
      3     -21.3217      2.00000
      4     -20.5330      2.00000
      5     -16.5674      2.00000
      6     -15.7355      2.00000
      7     -13.7054      2.00000
      8     -12.8715      2.00000
      9     -12.4056      2.00000
     10     -12.3454      2.00000
     11     -11.0111      2.00000
     12      -9.8994      2.00000
     13      -9.3186      2.00000
     14      -9.3127      2.00000
     15      -8.4815      2.00000
     16      -8.0687      2.00000
     17      -5.3872      2.00000
     18      -4.9904      2.00000
     19      -4.6154      2.00000
     20      -4.3059      2.00000
     21       1.8158      0.00000
     22       1.8329      0.00000
     23       2.8570      0.00000
     24       2.8665      0.00000
     25       3.1368      0.00000
     26       3.2446      0.00000
     27       3.4654      0.00000
     28       3.6289      0.00000

 k-point   223 :       0.3125    0.4000    0.3333
  band No.  band energies     occupation 
      1     -24.1992      2.00000
      2     -23.1934      2.00000
      3     -21.8347      2.00000
      4     -20.9841      2.00000
      5     -16.3376      2.00000
      6     -15.3343      2.00000
      7     -14.1531      2.00000
      8     -12.9163      2.00000
      9     -12.1450      2.00000
     10     -11.8030      2.00000
     11     -10.8017      2.00000
     12      -9.8094      2.00000
     13      -9.3671      2.00000
     14      -9.2360      2.00000
     15      -8.5544      2.00000
     16      -8.3227      2.00000
     17      -5.4123      2.00000
     18      -5.1670      2.00000
     19      -4.8224      2.00000
     20      -4.5106      2.00000
     21       2.0600      0.00000
     22       2.0750      0.00000
     23       2.8158      0.00000
     24       3.0356      0.00000
     25       3.3519      0.00000
     26       3.5658      0.00000
     27       3.7503      0.00000
     28       3.8304      0.00000

 k-point   224 :       0.3750    0.4000    0.3333
  band No.  band energies     occupation 
      1     -23.9159      2.00000
      2     -22.9221      2.00000
      3     -22.3264      2.00000
      4     -21.4296      2.00000
      5     -16.0649      2.00000
      6     -14.9423      2.00000
      7     -14.5919      2.00000
      8     -13.3156      2.00000
      9     -11.5438      2.00000
     10     -11.2383      2.00000
     11     -10.5827      2.00000
     12      -9.7905      2.00000
     13      -9.4508      2.00000
     14      -9.1671      2.00000
     15      -8.7113      2.00000
     16      -8.6228      2.00000
     17      -5.3905      2.00000
     18      -5.3071      2.00000
     19      -5.0407      2.00000
     20      -4.7313      2.00000
     21       2.3542      0.00000
     22       2.3819      0.00000
     23       2.8954      0.00000
     24       3.3034      0.00000
     25       3.5909      0.00000
     26       3.9367      0.00000
     27       3.9687      0.00000
     28       4.0438      0.00000

 k-point   225 :       0.4375    0.4000    0.3333
  band No.  band energies     occupation 
      1     -23.5843      2.00000
      2     -22.7859      2.00000
      3     -22.6062      2.00000
      4     -21.8544      2.00000
      5     -15.7508      2.00000
      6     -15.0094      2.00000
      7     -14.5492      2.00000
      8     -13.7345      2.00000
      9     -10.9177      2.00000
     10     -10.7870      2.00000
     11     -10.4327      2.00000
     12      -9.9489      2.00000
     13      -9.4574      2.00000
     14      -9.1030      2.00000
     15      -8.9619      2.00000
     16      -8.8772      2.00000
     17      -5.3759      2.00000
     18      -5.3048      2.00000
     19      -5.2300      2.00000
     20      -4.9540      2.00000
     21       2.7154      0.00000
     22       2.7306      0.00000
     23       3.1097      0.00000
     24       3.4483      0.00000
     25       3.7527      0.00000
     26       3.7623      0.00000
     27       4.1598      0.00000
     28       4.1661      0.00000

 k-point   226 :       0.5000    0.4000    0.3333
  band No.  band energies     occupation 
      1     -23.2070      2.00000
      2     -23.2063      2.00000
      3     -22.2490      2.00000
      4     -22.2486      2.00000
      5     -15.3978      2.00000
      6     -15.3974      2.00000
      7     -14.1477      2.00000
      8     -14.1469      2.00000
      9     -10.5023      2.00000
     10     -10.5008      2.00000
     11     -10.3529      2.00000
     12     -10.3517      2.00000
     13      -9.2601      2.00000
     14      -9.2583      2.00000
     15      -9.0220      2.00000
     16      -9.0208      2.00000
     17      -5.3515      2.00000
     18      -5.3488      2.00000
     19      -5.1546      2.00000
     20      -5.1532      2.00000
     21       3.0877      0.00000
     22       3.0898      0.00000
     23       3.1147      0.00000
     24       3.1151      0.00000
     25       3.7527      0.00000
     26       3.7531      0.00000
     27       4.0836      0.00000
     28       4.0860      0.00000

 k-point   227 :      -0.4375    0.4000    0.3333
  band No.  band energies     occupation 
      1     -23.5843      2.00000
      2     -22.7859      2.00000
      3     -22.6062      2.00000
      4     -21.8544      2.00000
      5     -15.7505      2.00000
      6     -15.0097      2.00000
      7     -14.5491      2.00000
      8     -13.7346      2.00000
      9     -10.9176      2.00000
     10     -10.7881      2.00000
     11     -10.4312      2.00000
     12      -9.9489      2.00000
     13      -9.4567      2.00000
     14      -9.1022      2.00000
     15      -8.9627      2.00000
     16      -8.8780      2.00000
     17      -5.3743      2.00000
     18      -5.3063      2.00000
     19      -5.2315      2.00000
     20      -4.9526      2.00000
     21       2.7154      0.00000
     22       2.7306      0.00000
     23       3.1094      0.00000
     24       3.4484      0.00000
     25       3.7523      0.00000
     26       3.7622      0.00000
     27       4.1601      0.00000
     28       4.1660      0.00000

 k-point   228 :      -0.3750    0.4000    0.3333
  band No.  band energies     occupation 
      1     -23.9159      2.00000
      2     -22.9221      2.00000
      3     -22.3264      2.00000
      4     -21.4296      2.00000
      5     -16.0647      2.00000
      6     -14.9423      2.00000
      7     -14.5923      2.00000
      8     -13.3157      2.00000
      9     -11.5437      2.00000
     10     -11.2393      2.00000
     11     -10.5809      2.00000
     12      -9.7905      2.00000
     13      -9.4507      2.00000
     14      -9.1668      2.00000
     15      -8.7118      2.00000
     16      -8.6234      2.00000
     17      -5.3921      2.00000
     18      -5.3055      2.00000
     19      -5.0420      2.00000
     20      -4.7301      2.00000
     21       2.3543      0.00000
     22       2.3817      0.00000
     23       2.8951      0.00000
     24       3.3033      0.00000
     25       3.5903      0.00000
     26       3.9368      0.00000
     27       3.9686      0.00000
     28       4.0443      0.00000

 k-point   229 :      -0.3125    0.4000    0.3333
  band No.  band energies     occupation 
      1     -24.1992      2.00000
      2     -23.1934      2.00000
      3     -21.8347      2.00000
      4     -20.9841      2.00000
      5     -16.3374      2.00000
      6     -15.3342      2.00000
      7     -14.1536      2.00000
      8     -12.9166      2.00000
      9     -12.1448      2.00000
     10     -11.8036      2.00000
     11     -10.7999      2.00000
     12      -9.8093      2.00000
     13      -9.3674      2.00000
     14      -9.2360      2.00000
     15      -8.5546      2.00000
     16      -8.3231      2.00000
     17      -5.4138      2.00000
     18      -5.1655      2.00000
     19      -4.8236      2.00000
     20      -4.5095      2.00000
     21       2.0601      0.00000
     22       2.0747      0.00000
     23       2.8156      0.00000
     24       3.0357      0.00000
     25       3.3511      0.00000
     26       3.5658      0.00000
     27       3.7506      0.00000
     28       3.8305      0.00000

 k-point   230 :      -0.2500    0.4000    0.3333
  band No.  band energies     occupation 
      1     -24.4327      2.00000
      2     -23.4178      2.00000
      3     -21.3216      2.00000
      4     -20.5330      2.00000
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     10     -12.3451      2.00000
     11     -11.0094      2.00000
     12      -9.8991      2.00000
     13      -9.3193      2.00000
     14      -9.3128      2.00000
     15      -8.4814      2.00000
     16      -8.0690      2.00000
     17      -5.3887      2.00000
     18      -4.9891      2.00000
     19      -4.6164      2.00000
     20      -4.3049      2.00000
     21       1.8154      0.00000
     22       1.8330      0.00000
     23       2.8567      0.00000
     24       2.8669      0.00000
     25       3.1360      0.00000
     26       3.2446      0.00000
     27       3.4655      0.00000
     28       3.6289      0.00000

 k-point   231 :      -0.1875    0.4000    0.3333
  band No.  band energies     occupation 
      1     -24.6153      2.00000
      2     -23.5939      2.00000
      3     -20.8059      2.00000
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     10     -12.0060      2.00000
     11     -11.1956      2.00000
     12     -10.0085      2.00000
     13      -9.3894      2.00000
     14      -9.3424      2.00000
     15      -8.4609      2.00000
     16      -7.8981      2.00000
     17      -5.3363      2.00000
     18      -4.8135      2.00000
     19      -4.4431      2.00000
     20      -4.1249      2.00000
     21       1.6125      0.00000
     22       1.6596      0.00000
     23       2.7469      0.00000
     24       2.8750      0.00000
     25       2.9760      0.00000
     26       3.0609      0.00000
     27       3.2616      0.00000
     28       3.4606      0.00000

 k-point   232 :      -0.1250    0.4000    0.3333
  band No.  band energies     occupation 
      1     -24.7463      2.00000
      2     -23.7203      2.00000
      3     -20.3235      2.00000
      4     -19.7226      2.00000
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      6     -16.5611      2.00000
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      8     -13.4757      2.00000
      9     -12.8529      2.00000
     10     -11.6727      2.00000
     11     -11.3594      2.00000
     12     -10.1151      2.00000
     13      -9.4540      2.00000
     14      -9.4253      2.00000
     15      -8.4640      2.00000
     16      -7.8094      2.00000
     17      -5.2753      2.00000
     18      -4.6706      2.00000
     19      -4.3100      2.00000
     20      -3.9808      2.00000
     21       1.4694      0.00000
     22       1.5329      0.00000
     23       2.6348      0.00000
     24       2.7808      0.00000
     25       2.8242      0.00000
     26       2.9871      0.00000
     27       3.2086      0.00000
     28       3.3417      0.00000

 k-point   233 :      -0.0625    0.4000    0.3333
  band No.  band energies     occupation 
      1     -24.8251      2.00000
      2     -23.7965      2.00000
      3     -19.9468      2.00000
      4     -19.4546      2.00000
      5     -16.9849      2.00000
      6     -16.8980      2.00000
      7     -13.8453      2.00000
      8     -13.8042      2.00000
      9     -12.5393      2.00000
     10     -11.4963      2.00000
     11     -11.4290      2.00000
     12     -10.2008      2.00000
     13      -9.5179      2.00000
     14      -9.4972      2.00000
     15      -8.4722      2.00000
     16      -7.7780      2.00000
     17      -5.2257      2.00000
     18      -4.5799      2.00000
     19      -4.2225      2.00000
     20      -3.8866      2.00000
     21       1.3854      0.00000
     22       1.4545      0.00000
     23       2.5590      0.00000
     24       2.6790      0.00000
     25       2.7348      0.00000
     26       2.9072      0.00000
     27       3.1704      0.00000
     28       3.3206      0.00000

 k-point   234 :       0.0000    0.4667    0.3333
  band No.  band energies     occupation 
      1     -24.5476      2.00000
      2     -24.2032      2.00000
      3     -19.6156      2.00000
      4     -19.4563      2.00000
      5     -17.0320      2.00000
      6     -17.0271      2.00000
      7     -14.0182      2.00000
      8     -14.0166      2.00000
      9     -11.9998      2.00000
     10     -11.6373      2.00000
     11     -11.1033      2.00000
     12     -10.6469      2.00000
     13      -9.5106      2.00000
     14      -9.5063      2.00000
     15      -8.2032      2.00000
     16      -7.9573      2.00000
     17      -5.0363      2.00000
     18      -4.8055      2.00000
     19      -4.1325      2.00000
     20      -4.0132      2.00000
     21       1.6613      0.00000
     22       1.7332      0.00000
     23       2.2929      0.00000
     24       2.3998      0.00000
     25       3.1167      0.00000
     26       3.2865      0.00000
     27       3.4502      0.00000
     28       3.5409      0.00000

 k-point   235 :       0.0625    0.4667    0.3333
  band No.  band energies     occupation 
      1     -24.5215      2.00000
      2     -24.1775      2.00000
      3     -19.7565      2.00000
      4     -19.5805      2.00000
      5     -16.9576      2.00000
      6     -16.9170      2.00000
      7     -13.9302      2.00000
      8     -13.9137      2.00000
      9     -12.1246      2.00000
     10     -11.7497      2.00000
     11     -11.0434      2.00000
     12     -10.5954      2.00000
     13      -9.4887      2.00000
     14      -9.4777      2.00000
     15      -8.1962      2.00000
     16      -7.9546      2.00000
     17      -5.0615      2.00000
     18      -4.8351      2.00000
     19      -4.1639      2.00000
     20      -4.0460      2.00000
     21       1.6902      0.00000
     22       1.7617      0.00000
     23       2.3167      0.00000
     24       2.4259      0.00000
     25       3.1523      0.00000
     26       3.3115      0.00000
     27       3.4490      0.00000
     28       3.5405      0.00000

 k-point   236 :       0.1250    0.4667    0.3333
  band No.  band energies     occupation 
      1     -24.4434      2.00000
      2     -24.1002      2.00000
      3     -20.1120      2.00000
      4     -19.9019      2.00000
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      7     -13.6748      2.00000
      8     -13.6158      2.00000
      9     -12.4271      2.00000
     10     -12.0303      2.00000
     11     -10.9144      2.00000
     12     -10.4812      2.00000
     13      -9.4322      2.00000
     14      -9.4071      2.00000
     15      -8.1870      2.00000
     16      -7.9616      2.00000
     17      -5.1306      2.00000
     18      -4.9187      2.00000
     19      -4.2535      2.00000
     20      -4.1391      2.00000
     21       1.7774      0.00000
     22       1.8461      0.00000
     23       2.3861      0.00000
     24       2.4965      0.00000
     25       3.2533      0.00000
     26       3.3156      0.00000
     27       3.4539      0.00000
     28       3.4953      0.00000

 k-point   237 :       0.1875    0.4667    0.3333
  band No.  band energies     occupation 
      1     -24.3135      2.00000
      2     -23.9719      2.00000
      3     -20.5737      2.00000
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      5     -16.5394      2.00000
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      7     -13.2737      2.00000
      8     -13.1787      2.00000
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     10     -12.3936      2.00000
     11     -10.7638      2.00000
     12     -10.3476      2.00000
     13      -9.3577      2.00000
     14      -9.3290      2.00000
     15      -8.2055      2.00000
     16      -8.0136      2.00000
     17      -5.2267      2.00000
     18      -5.0428      2.00000
     19      -4.3902      2.00000
     20      -4.2809      2.00000
     21       1.9244      0.00000
     22       1.9817      0.00000
     23       2.4916      0.00000
     24       2.5836      0.00000
     25       3.1978      0.00000
     26       3.3494      0.00000
     27       3.4551      0.00000
     28       3.6227      0.00000

 k-point   238 :       0.2500    0.4667    0.3333
  band No.  band energies     occupation 
      1     -24.1326      2.00000
      2     -23.7930      2.00000
      3     -21.0727      2.00000
      4     -20.8046      2.00000
      5     -16.2792      2.00000
      6     -15.9940      2.00000
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      8     -12.9423      2.00000
      9     -12.6089      2.00000
     10     -12.5600      2.00000
     11     -10.6018      2.00000
     12     -10.2096      2.00000
     13      -9.2829      2.00000
     14      -9.2730      2.00000
     15      -8.2850      2.00000
     16      -8.1436      2.00000
     17      -5.3286      2.00000
     18      -5.1874      2.00000
     19      -4.5647      2.00000
     20      -4.4591      2.00000
     21       2.1304      0.00000
     22       2.1593      0.00000
     23       2.6192      0.00000
     24       2.6422      0.00000
     25       3.1796      0.00000
     26       3.3300      0.00000
     27       3.7024      0.00000
     28       3.8552      0.00000

 k-point   239 :       0.3125    0.4667    0.3333
  band No.  band energies     occupation 
      1     -23.9013      2.00000
      2     -23.5647      2.00000
      3     -21.5727      2.00000
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      5     -15.9961      2.00000
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      7     -13.7183      2.00000
      8     -13.3002      2.00000
      9     -12.0729      2.00000
     10     -11.9425      2.00000
     11     -10.4344      2.00000
     12     -10.0797      2.00000
     13      -9.2576      2.00000
     14      -9.2224      2.00000
     15      -8.4457      2.00000
     16      -8.3644      2.00000
     17      -5.4121      2.00000
     18      -5.3238      2.00000
     19      -4.7706      2.00000
     20      -4.6649      2.00000
     21       2.3746      0.00000
     22       2.3897      0.00000
     23       2.7041      0.00000
     24       2.7920      0.00000
     25       3.3203      0.00000
     26       3.4696      0.00000
     27       4.0262      0.00000
     28       4.1471      0.00000

 k-point   240 :       0.3750    0.4667    0.3333
  band No.  band energies     occupation 
      1     -23.6210      2.00000
      2     -23.2883      2.00000
      3     -22.0542      2.00000
      4     -21.7524      2.00000
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      8     -13.7293      2.00000
      9     -11.4351      2.00000
     10     -11.3143      2.00000
     11     -10.2821      2.00000
     12      -9.9894      2.00000
     13      -9.2821      2.00000
     14      -9.1870      2.00000
     15      -8.6872      2.00000
     16      -8.6570      2.00000
     17      -5.4478      2.00000
     18      -5.4165      2.00000
     19      -4.9930      2.00000
     20      -4.8883      2.00000
     21       2.6494      0.00000
     22       2.6899      0.00000
     23       2.8826      0.00000
     24       3.0545      0.00000
     25       3.5456      0.00000
     26       3.6800      0.00000
     27       4.3769      0.00000
     28       4.4465      0.00000

 k-point   241 :       0.4375    0.4667    0.3333
  band No.  band energies     occupation 
      1     -23.2932      2.00000
      2     -22.9656      2.00000
      3     -22.5058      2.00000
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      5     -15.3467      2.00000
      6     -14.9441      2.00000
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      8     -14.1525      2.00000
      9     -10.8178      2.00000
     10     -10.7476      2.00000
     11     -10.2080      2.00000
     12     -10.0225      2.00000
     13      -9.3043      2.00000
     14      -9.1691      2.00000
     15      -8.9756      2.00000
     16      -8.9472      2.00000
     17      -5.4335      2.00000
     18      -5.4101      2.00000
     19      -5.2014      2.00000
     20      -5.1082      2.00000
     21       3.0039      0.00000
     22       3.0378      0.00000
     23       3.1924      0.00000
     24       3.3910      0.00000
     25       3.6620      0.00000
     26       3.7650      0.00000
     27       4.1727      0.00000
     28       4.1895      0.00000

 k-point   242 :       0.5000    0.4667    0.3333
  band No.  band energies     occupation 
      1     -22.9207      2.00000
      2     -22.9201      2.00000
      3     -22.5995      2.00000
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      5     -14.9770      2.00000
      6     -14.9767      2.00000
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      8     -14.5585      2.00000
      9     -10.3453      2.00000
     10     -10.3437      2.00000
     11     -10.3070      2.00000
     12     -10.3056      2.00000
     13      -9.2173      2.00000
     14      -9.2156      2.00000
     15      -9.1183      2.00000
     16      -9.1170      2.00000
     17      -5.3596      2.00000
     18      -5.3574      2.00000
     19      -5.2929      2.00000
     20      -5.2912      2.00000
     21       3.3783      0.00000
     22       3.3803      0.00000
     23       3.3892      0.00000
     24       3.3898      0.00000
     25       3.7310      0.00000
     26       3.7317      0.00000
     27       3.8105      0.00000
     28       3.8130      0.00000

 k-point   243 :      -0.4375    0.4667    0.3333
  band No.  band energies     occupation 
      1     -23.2932      2.00000
      2     -22.9656      2.00000
      3     -22.5058      2.00000
      4     -22.1931      2.00000
      5     -15.3466      2.00000
      6     -14.9442      2.00000
      7     -14.5787      2.00000
      8     -14.1524      2.00000
      9     -10.8174      2.00000
     10     -10.7484      2.00000
     11     -10.2066      2.00000
     12     -10.0233      2.00000
     13      -9.3044      2.00000
     14      -9.1683      2.00000
     15      -8.9759      2.00000
     16      -8.9478      2.00000
     17      -5.4319      2.00000
     18      -5.4116      2.00000
     19      -5.2029      2.00000
     20      -5.1068      2.00000
     21       3.0042      0.00000
     22       3.0377      0.00000
     23       3.1922      0.00000
     24       3.3904      0.00000
     25       3.6622      0.00000
     26       3.7649      0.00000
     27       4.1728      0.00000
     28       4.1897      0.00000

 k-point   244 :      -0.3750    0.4667    0.3333
  band No.  band energies     occupation 
      1     -23.6210      2.00000
      2     -23.2883      2.00000
      3     -22.0542      2.00000
      4     -21.7524      2.00000
      5     -15.6861      2.00000
      6     -15.3087      2.00000
      7     -14.1565      2.00000
      8     -13.7292      2.00000
      9     -11.4348      2.00000
     10     -11.3148      2.00000
     11     -10.2807      2.00000
     12      -9.9902      2.00000
     13      -9.2825      2.00000
     14      -9.1864      2.00000
     15      -8.6873      2.00000
     16      -8.6574      2.00000
     17      -5.4494      2.00000
     18      -5.4149      2.00000
     19      -4.9943      2.00000
     20      -4.8870      2.00000
     21       2.6498      0.00000
     22       2.6896      0.00000
     23       2.8825      0.00000
     24       3.0541      0.00000
     25       3.5458      0.00000
     26       3.6800      0.00000
     27       4.3773      0.00000
     28       4.4466      0.00000

 k-point   245 :      -0.3125    0.4667    0.3333
  band No.  band energies     occupation 
      1     -23.9013      2.00000
      2     -23.5647      2.00000
      3     -21.5726      2.00000
      4     -21.2854      2.00000
      5     -15.9959      2.00000
      6     -15.6563      2.00000
      7     -13.7186      2.00000
      8     -13.3002      2.00000
      9     -12.0726      2.00000
     10     -11.9429      2.00000
     11     -10.4331      2.00000
     12     -10.0805      2.00000
     13      -9.2581      2.00000
     14      -9.2219      2.00000
     15      -8.4456      2.00000
     16      -8.3647      2.00000
     17      -5.4136      2.00000
     18      -5.3222      2.00000
     19      -4.7717      2.00000
     20      -4.6638      2.00000
     21       2.3749      0.00000
     22       2.3893      0.00000
     23       2.7039      0.00000
     24       2.7919      0.00000
     25       3.3204      0.00000
     26       3.4696      0.00000
     27       4.0262      0.00000
     28       4.1472      0.00000

 k-point   246 :      -0.2500    0.4667    0.3333
  band No.  band energies     occupation 
      1     -24.1326      2.00000
      2     -23.7930      2.00000
      3     -21.0726      2.00000
      4     -20.8047      2.00000
      5     -16.2791      2.00000
      6     -15.9941      2.00000
      7     -13.2822      2.00000
      8     -12.9426      2.00000
      9     -12.6085      2.00000
     10     -12.5603      2.00000
     11     -10.6005      2.00000
     12     -10.2104      2.00000
     13      -9.2825      2.00000
     14      -9.2736      2.00000
     15      -8.2848      2.00000
     16      -8.1439      2.00000
     17      -5.3301      2.00000
     18      -5.1861      2.00000
     19      -4.5657      2.00000
     20      -4.4581      2.00000
     21       2.1301      0.00000
     22       2.1595      0.00000
     23       2.6194      0.00000
     24       2.6420      0.00000
     25       3.1795      0.00000
     26       3.3301      0.00000
     27       3.7025      0.00000
     28       3.8551      0.00000

 k-point   247 :      -0.1875    0.4667    0.3333
  band No.  band energies     occupation 
      1     -24.3135      2.00000
      2     -23.9718      2.00000
      3     -20.5737      2.00000
      4     -20.3313      2.00000
      5     -16.5393      2.00000
      6     -16.3283      2.00000
      7     -13.2738      2.00000
      8     -13.1786      2.00000
      9     -12.7993      2.00000
     10     -12.3932      2.00000
     11     -10.7625      2.00000
     12     -10.3483      2.00000
     13      -9.3574      2.00000
     14      -9.3297      2.00000
     15      -8.2052      2.00000
     16      -8.0138      2.00000
     17      -5.2279      2.00000
     18      -5.0417      2.00000
     19      -4.3909      2.00000
     20      -4.2802      2.00000
     21       1.9241      0.00000
     22       1.9818      0.00000
     23       2.4920      0.00000
     24       2.5834      0.00000
     25       3.1977      0.00000
     26       3.3494      0.00000
     27       3.4551      0.00000
     28       3.6228      0.00000

 k-point   248 :      -0.1250    0.4667    0.3333
  band No.  band energies     occupation 
      1     -24.4434      2.00000
      2     -24.1002      2.00000
      3     -20.1120      2.00000
      4     -19.9020      2.00000
      5     -16.7738      2.00000
      6     -16.6515      2.00000
      7     -13.6748      2.00000
      8     -13.6159      2.00000
      9     -12.4277      2.00000
     10     -12.0300      2.00000
     11     -10.9132      2.00000
     12     -10.4818      2.00000
     13      -9.4319      2.00000
     14      -9.4077      2.00000
     15      -8.1867      2.00000
     16      -7.9617      2.00000
     17      -5.1315      2.00000
     18      -4.9179      2.00000
     19      -4.2540      2.00000
     20      -4.1386      2.00000
     21       1.7772      0.00000
     22       1.8462      0.00000
     23       2.3864      0.00000
     24       2.4963      0.00000
     25       3.2532      0.00000
     26       3.3156      0.00000
     27       3.4531      0.00000
     28       3.4962      0.00000

 k-point   249 :      -0.0625    0.4667    0.3333
  band No.  band energies     occupation 
      1     -24.5215      2.00000
      2     -24.1775      2.00000
      3     -19.7565      2.00000
      4     -19.5805      2.00000
      5     -16.9576      2.00000
      6     -16.9170      2.00000
      7     -13.9302      2.00000
      8     -13.9137      2.00000
      9     -12.1251      2.00000
     10     -11.7495      2.00000
     11     -11.0426      2.00000
     12     -10.5958      2.00000
     13      -9.4886      2.00000
     14      -9.4780      2.00000
     15      -8.1961      2.00000
     16      -7.9547      2.00000
     17      -5.0620      2.00000
     18      -4.8347      2.00000
     19      -4.1642      2.00000
     20      -4.0457      2.00000
     21       1.6901      0.00000
     22       1.7618      0.00000
     23       2.3168      0.00000
     24       2.4259      0.00000
     25       3.1523      0.00000
     26       3.3115      0.00000
     27       3.4485      0.00000
     28       3.5413      0.00000

 k-point   250 :       0.0000   -0.4667    0.3333
  band No.  band energies     occupation 
      1     -24.5476      2.00000
      2     -24.2032      2.00000
      3     -19.6156      2.00000
      4     -19.4563      2.00000
      5     -17.0320      2.00000
      6     -17.0271      2.00000
      7     -14.0182      2.00000
      8     -14.0166      2.00000
      9     -11.9998      2.00000
     10     -11.6373      2.00000
     11     -11.1033      2.00000
     12     -10.6469      2.00000
     13      -9.5106      2.00000
     14      -9.5063      2.00000
     15      -8.2032      2.00000
     16      -7.9573      2.00000
     17      -5.0363      2.00000
     18      -4.8055      2.00000
     19      -4.1325      2.00000
     20      -4.0132      2.00000
     21       1.6613      0.00000
     22       1.7332      0.00000
     23       2.2929      0.00000
     24       2.3998      0.00000
     25       3.1167      0.00000
     26       3.2865      0.00000
     27       3.4501      0.00000
     28       3.5417      0.00000

 k-point   251 :       0.0625   -0.4667    0.3333
  band No.  band energies     occupation 
      1     -24.5215      2.00000
      2     -24.1775      2.00000
      3     -19.7565      2.00000
      4     -19.5805      2.00000
      5     -16.9576      2.00000
      6     -16.9170      2.00000
      7     -13.9302      2.00000
      8     -13.9137      2.00000
      9     -12.1251      2.00000
     10     -11.7495      2.00000
     11     -11.0426      2.00000
     12     -10.5958      2.00000
     13      -9.4886      2.00000
     14      -9.4780      2.00000
     15      -8.1961      2.00000
     16      -7.9547      2.00000
     17      -5.0620      2.00000
     18      -4.8347      2.00000
     19      -4.1642      2.00000
     20      -4.0457      2.00000
     21       1.6901      0.00000
     22       1.7618      0.00000
     23       2.3168      0.00000
     24       2.4259      0.00000
     25       3.1523      0.00000
     26       3.3114      0.00000
     27       3.4487      0.00000
     28       3.5412      0.00000

 k-point   252 :       0.1250   -0.4667    0.3333
  band No.  band energies     occupation 
      1     -24.4434      2.00000
      2     -24.1002      2.00000
      3     -20.1120      2.00000
      4     -19.9020      2.00000
      5     -16.7738      2.00000
      6     -16.6515      2.00000
      7     -13.6748      2.00000
      8     -13.6159      2.00000
      9     -12.4277      2.00000
     10     -12.0300      2.00000
     11     -10.9132      2.00000
     12     -10.4818      2.00000
     13      -9.4319      2.00000
     14      -9.4077      2.00000
     15      -8.1867      2.00000
     16      -7.9617      2.00000
     17      -5.1315      2.00000
     18      -4.9179      2.00000
     19      -4.2540      2.00000
     20      -4.1386      2.00000
     21       1.7772      0.00000
     22       1.8462      0.00000
     23       2.3864      0.00000
     24       2.4963      0.00000
     25       3.2533      0.00000
     26       3.3154      0.00000
     27       3.4539      0.00000
     28       3.4953      0.00000

 k-point   253 :       0.1875   -0.4667    0.3333
  band No.  band energies     occupation 
      1     -24.3135      2.00000
      2     -23.9718      2.00000
      3     -20.5737      2.00000
      4     -20.3313      2.00000
      5     -16.5393      2.00000
      6     -16.3283      2.00000
      7     -13.2738      2.00000
      8     -13.1786      2.00000
      9     -12.7993      2.00000
     10     -12.3932      2.00000
     11     -10.7625      2.00000
     12     -10.3483      2.00000
     13      -9.3574      2.00000
     14      -9.3297      2.00000
     15      -8.2052      2.00000
     16      -8.0138      2.00000
     17      -5.2279      2.00000
     18      -5.0417      2.00000
     19      -4.3909      2.00000
     20      -4.2802      2.00000
     21       1.9241      0.00000
     22       1.9818      0.00000
     23       2.4920      0.00000
     24       2.5834      0.00000
     25       3.1977      0.00000
     26       3.3494      0.00000
     27       3.4551      0.00000
     28       3.6227      0.00000

 k-point   254 :       0.2500   -0.4667    0.3333
  band No.  band energies     occupation 
      1     -24.1326      2.00000
      2     -23.7930      2.00000
      3     -21.0726      2.00000
      4     -20.8047      2.00000
      5     -16.2791      2.00000
      6     -15.9941      2.00000
      7     -13.2822      2.00000
      8     -12.9426      2.00000
      9     -12.6085      2.00000
     10     -12.5603      2.00000
     11     -10.6005      2.00000
     12     -10.2104      2.00000
     13      -9.2825      2.00000
     14      -9.2736      2.00000
     15      -8.2848      2.00000
     16      -8.1439      2.00000
     17      -5.3301      2.00000
     18      -5.1861      2.00000
     19      -4.5657      2.00000
     20      -4.4581      2.00000
     21       2.1301      0.00000
     22       2.1595      0.00000
     23       2.6194      0.00000
     24       2.6420      0.00000
     25       3.1795      0.00000
     26       3.3301      0.00000
     27       3.7025      0.00000
     28       3.8552      0.00000

 k-point   255 :       0.3125   -0.4667    0.3333
  band No.  band energies     occupation 
      1     -23.9013      2.00000
      2     -23.5647      2.00000
      3     -21.5726      2.00000
      4     -21.2854      2.00000
      5     -15.9959      2.00000
      6     -15.6563      2.00000
      7     -13.7186      2.00000
      8     -13.3002      2.00000
      9     -12.0726      2.00000
     10     -11.9429      2.00000
     11     -10.4331      2.00000
     12     -10.0805      2.00000
     13      -9.2581      2.00000
     14      -9.2219      2.00000
     15      -8.4456      2.00000
     16      -8.3647      2.00000
     17      -5.4136      2.00000
     18      -5.3222      2.00000
     19      -4.7717      2.00000
     20      -4.6638      2.00000
     21       2.3749      0.00000
     22       2.3893      0.00000
     23       2.7039      0.00000
     24       2.7919      0.00000
     25       3.3204      0.00000
     26       3.4696      0.00000
     27       4.0262      0.00000
     28       4.1472      0.00000

 k-point   256 :       0.3750   -0.4667    0.3333
  band No.  band energies     occupation 
      1     -23.6210      2.00000
      2     -23.2883      2.00000
      3     -22.0542      2.00000
      4     -21.7524      2.00000
      5     -15.6861      2.00000
      6     -15.3087      2.00000
      7     -14.1565      2.00000
      8     -13.7292      2.00000
      9     -11.4348      2.00000
     10     -11.3148      2.00000
     11     -10.2807      2.00000
     12      -9.9902      2.00000
     13      -9.2825      2.00000
     14      -9.1864      2.00000
     15      -8.6873      2.00000
     16      -8.6574      2.00000
     17      -5.4494      2.00000
     18      -5.4149      2.00000
     19      -4.9943      2.00000
     20      -4.8870      2.00000
     21       2.6498      0.00000
     22       2.6896      0.00000
     23       2.8825      0.00000
     24       3.0541      0.00000
     25       3.5458      0.00000
     26       3.6800      0.00000
     27       4.3773      0.00000
     28       4.4466      0.00000

 k-point   257 :       0.4375   -0.4667    0.3333
  band No.  band energies     occupation 
      1     -23.2932      2.00000
      2     -22.9656      2.00000
      3     -22.5058      2.00000
      4     -22.1931      2.00000
      5     -15.3466      2.00000
      6     -14.9442      2.00000
      7     -14.5787      2.00000
      8     -14.1524      2.00000
      9     -10.8174      2.00000
     10     -10.7484      2.00000
     11     -10.2066      2.00000
     12     -10.0233      2.00000
     13      -9.3044      2.00000
     14      -9.1683      2.00000
     15      -8.9759      2.00000
     16      -8.9478      2.00000
     17      -5.4319      2.00000
     18      -5.4116      2.00000
     19      -5.2029      2.00000
     20      -5.1068      2.00000
     21       3.0042      0.00000
     22       3.0377      0.00000
     23       3.1922      0.00000
     24       3.3904      0.00000
     25       3.6622      0.00000
     26       3.7649      0.00000
     27       4.1728      0.00000
     28       4.1897      0.00000

 k-point   258 :       0.5000   -0.4667    0.3333
  band No.  band energies     occupation 
      1     -22.9207      2.00000
      2     -22.9201      2.00000
      3     -22.5995      2.00000
      4     -22.5990      2.00000
      5     -14.9770      2.00000
      6     -14.9767      2.00000
      7     -14.5591      2.00000
      8     -14.5585      2.00000
      9     -10.3453      2.00000
     10     -10.3437      2.00000
     11     -10.3070      2.00000
     12     -10.3056      2.00000
     13      -9.2173      2.00000
     14      -9.2156      2.00000
     15      -9.1183      2.00000
     16      -9.1170      2.00000
     17      -5.3596      2.00000
     18      -5.3574      2.00000
     19      -5.2929      2.00000
     20      -5.2912      2.00000
     21       3.3783      0.00000
     22       3.3803      0.00000
     23       3.3892      0.00000
     24       3.3898      0.00000
     25       3.7310      0.00000
     26       3.7317      0.00000
     27       3.8105      0.00000
     28       3.8130      0.00000

 k-point   259 :      -0.4375   -0.4667    0.3333
  band No.  band energies     occupation 
      1     -23.2932      2.00000
      2     -22.9656      2.00000
      3     -22.5058      2.00000
      4     -22.1931      2.00000
      5     -15.3467      2.00000
      6     -14.9441      2.00000
      7     -14.5785      2.00000
      8     -14.1525      2.00000
      9     -10.8178      2.00000
     10     -10.7476      2.00000
     11     -10.2080      2.00000
     12     -10.0225      2.00000
     13      -9.3043      2.00000
     14      -9.1691      2.00000
     15      -8.9756      2.00000
     16      -8.9472      2.00000
     17      -5.4335      2.00000
     18      -5.4101      2.00000
     19      -5.2014      2.00000
     20      -5.1082      2.00000
     21       3.0039      0.00000
     22       3.0378      0.00000
     23       3.1924      0.00000
     24       3.3910      0.00000
     25       3.6620      0.00000
     26       3.7650      0.00000
     27       4.1727      0.00000
     28       4.1895      0.00000

 k-point   260 :      -0.3750   -0.4667    0.3333
  band No.  band energies     occupation 
      1     -23.6210      2.00000
      2     -23.2883      2.00000
      3     -22.0542      2.00000
      4     -21.7524      2.00000
      5     -15.6862      2.00000
      6     -15.3086      2.00000
      7     -14.1563      2.00000
      8     -13.7293      2.00000
      9     -11.4351      2.00000
     10     -11.3143      2.00000
     11     -10.2821      2.00000
     12      -9.9894      2.00000
     13      -9.2821      2.00000
     14      -9.1870      2.00000
     15      -8.6872      2.00000
     16      -8.6570      2.00000
     17      -5.4478      2.00000
     18      -5.4165      2.00000
     19      -4.9930      2.00000
     20      -4.8883      2.00000
     21       2.6494      0.00000
     22       2.6899      0.00000
     23       2.8826      0.00000
     24       3.0545      0.00000
     25       3.5456      0.00000
     26       3.6800      0.00000
     27       4.3769      0.00000
     28       4.4466      0.00000

 k-point   261 :      -0.3125   -0.4667    0.3333
  band No.  band energies     occupation 
      1     -23.9013      2.00000
      2     -23.5647      2.00000
      3     -21.5727      2.00000
      4     -21.2854      2.00000
      5     -15.9961      2.00000
      6     -15.6563      2.00000
      7     -13.7183      2.00000
      8     -13.3002      2.00000
      9     -12.0729      2.00000
     10     -11.9425      2.00000
     11     -10.4344      2.00000
     12     -10.0797      2.00000
     13      -9.2576      2.00000
     14      -9.2224      2.00000
     15      -8.4457      2.00000
     16      -8.3644      2.00000
     17      -5.4121      2.00000
     18      -5.3238      2.00000
     19      -4.7706      2.00000
     20      -4.6649      2.00000
     21       2.3746      0.00000
     22       2.3897      0.00000
     23       2.7041      0.00000
     24       2.7920      0.00000
     25       3.3203      0.00000
     26       3.4696      0.00000
     27       4.0262      0.00000
     28       4.1471      0.00000

 k-point   262 :      -0.2500   -0.4667    0.3333
  band No.  band energies     occupation 
      1     -24.1326      2.00000
      2     -23.7930      2.00000
      3     -21.0727      2.00000
      4     -20.8046      2.00000
      5     -16.2792      2.00000
      6     -15.9940      2.00000
      7     -13.2820      2.00000
      8     -12.9423      2.00000
      9     -12.6089      2.00000
     10     -12.5600      2.00000
     11     -10.6018      2.00000
     12     -10.2096      2.00000
     13      -9.2829      2.00000
     14      -9.2730      2.00000
     15      -8.2850      2.00000
     16      -8.1436      2.00000
     17      -5.3286      2.00000
     18      -5.1874      2.00000
     19      -4.5647      2.00000
     20      -4.4591      2.00000
     21       2.1304      0.00000
     22       2.1593      0.00000
     23       2.6192      0.00000
     24       2.6422      0.00000
     25       3.1796      0.00000
     26       3.3300      0.00000
     27       3.7025      0.00000
     28       3.8551      0.00000

 k-point   263 :      -0.1875   -0.4667    0.3333
  band No.  band energies     occupation 
      1     -24.3135      2.00000
      2     -23.9719      2.00000
      3     -20.5737      2.00000
      4     -20.3313      2.00000
      5     -16.5394      2.00000
      6     -16.3283      2.00000
      7     -13.2737      2.00000
      8     -13.1787      2.00000
      9     -12.7987      2.00000
     10     -12.3936      2.00000
     11     -10.7638      2.00000
     12     -10.3476      2.00000
     13      -9.3577      2.00000
     14      -9.3290      2.00000
     15      -8.2055      2.00000
     16      -8.0136      2.00000
     17      -5.2267      2.00000
     18      -5.0428      2.00000
     19      -4.3902      2.00000
     20      -4.2809      2.00000
     21       1.9244      0.00000
     22       1.9817      0.00000
     23       2.4916      0.00000
     24       2.5836      0.00000
     25       3.1978      0.00000
     26       3.3494      0.00000
     27       3.4551      0.00000
     28       3.6227      0.00000

 k-point   264 :      -0.1250   -0.4667    0.3333
  band No.  band energies     occupation 
      1     -24.4434      2.00000
      2     -24.1002      2.00000
      3     -20.1120      2.00000
      4     -19.9019      2.00000
      5     -16.7739      2.00000
      6     -16.6514      2.00000
      7     -13.6748      2.00000
      8     -13.6158      2.00000
      9     -12.4271      2.00000
     10     -12.0303      2.00000
     11     -10.9144      2.00000
     12     -10.4812      2.00000
     13      -9.4322      2.00000
     14      -9.4071      2.00000
     15      -8.1870      2.00000
     16      -7.9616      2.00000
     17      -5.1306      2.00000
     18      -4.9187      2.00000
     19      -4.2535      2.00000
     20      -4.1391      2.00000
     21       1.7774      0.00000
     22       1.8461      0.00000
     23       2.3861      0.00000
     24       2.4965      0.00000
     25       3.2532      0.00000
     26       3.3157      0.00000
     27       3.4533      0.00000
     28       3.4960      0.00000

 k-point   265 :      -0.0625   -0.4667    0.3333
  band No.  band energies     occupation 
      1     -24.5215      2.00000
      2     -24.1775      2.00000
      3     -19.7565      2.00000
      4     -19.5805      2.00000
      5     -16.9576      2.00000
      6     -16.9170      2.00000
      7     -13.9302      2.00000
      8     -13.9137      2.00000
      9     -12.1246      2.00000
     10     -11.7497      2.00000
     11     -11.0434      2.00000
     12     -10.5954      2.00000
     13      -9.4887      2.00000
     14      -9.4777      2.00000
     15      -8.1962      2.00000
     16      -7.9546      2.00000
     17      -5.0615      2.00000
     18      -4.8351      2.00000
     19      -4.1639      2.00000
     20      -4.0460      2.00000
     21       1.6902      0.00000
     22       1.7617      0.00000
     23       2.3167      0.00000
     24       2.4259      0.00000
     25       3.1523      0.00000
     26       3.3115      0.00000
     27       3.4487      0.00000
     28       3.5413      0.00000

 k-point   266 :       0.0000   -0.4000    0.3333
  band No.  band energies     occupation 
      1     -24.8514      2.00000
      2     -23.8219      2.00000
      3     -19.7954      2.00000
      4     -19.3557      2.00000
      5     -17.0371      2.00000
      6     -17.0172      2.00000
      7     -13.9226      2.00000
      8     -13.9145      2.00000
      9     -12.4074      2.00000
     10     -11.5609      2.00000
     11     -11.3365      2.00000
     12     -10.2364      2.00000
     13      -9.5581      2.00000
     14      -9.5125      2.00000
     15      -8.4760      2.00000
     16      -7.7724      2.00000
     17      -5.2064      2.00000
     18      -4.5492      2.00000
     19      -4.1914      2.00000
     20      -3.8538      2.00000
     21       1.3578      0.00000
     22       1.4279      0.00000
     23       2.5329      0.00000
     24       2.6429      0.00000
     25       2.7012      0.00000
     26       2.8774      0.00000
     27       3.1457      0.00000
     28       3.3062      0.00000

 k-point   267 :       0.0625   -0.4000    0.3333
  band No.  band energies     occupation 
      1     -24.8251      2.00000
      2     -23.7965      2.00000
      3     -19.9468      2.00000
      4     -19.4546      2.00000
      5     -16.9849      2.00000
      6     -16.8980      2.00000
      7     -13.8453      2.00000
      8     -13.8042      2.00000
      9     -12.5393      2.00000
     10     -11.4963      2.00000
     11     -11.4290      2.00000
     12     -10.2008      2.00000
     13      -9.5179      2.00000
     14      -9.4972      2.00000
     15      -8.4722      2.00000
     16      -7.7780      2.00000
     17      -5.2257      2.00000
     18      -4.5799      2.00000
     19      -4.2225      2.00000
     20      -3.8866      2.00000
     21       1.3854      0.00000
     22       1.4545      0.00000
     23       2.5590      0.00000
     24       2.6789      0.00000
     25       2.7349      0.00000
     26       2.9072      0.00000
     27       3.1705      0.00000
     28       3.3204      0.00000

 k-point   268 :       0.1250   -0.4000    0.3333
  band No.  band energies     occupation 
      1     -24.7463      2.00000
      2     -23.7203      2.00000
      3     -20.3235      2.00000
      4     -19.7226      2.00000
      5     -16.8939      2.00000
      6     -16.5611      2.00000
      7     -13.6371      2.00000
      8     -13.4757      2.00000
      9     -12.8529      2.00000
     10     -11.6727      2.00000
     11     -11.3594      2.00000
     12     -10.1151      2.00000
     13      -9.4540      2.00000
     14      -9.4253      2.00000
     15      -8.4640      2.00000
     16      -7.8094      2.00000
     17      -5.2753      2.00000
     18      -4.6706      2.00000
     19      -4.3100      2.00000
     20      -3.9808      2.00000
     21       1.4694      0.00000
     22       1.5329      0.00000
     23       2.6348      0.00000
     24       2.7808      0.00000
     25       2.8242      0.00000
     26       2.9871      0.00000
     27       3.2088      0.00000
     28       3.3415      0.00000

 k-point   269 :       0.1875   -0.4000    0.3333
  band No.  band energies     occupation 
      1     -24.6153      2.00000
      2     -23.5939      2.00000
      3     -20.8059      2.00000
      4     -20.1000      2.00000
      5     -16.7531      2.00000
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     11     -11.1956      2.00000
     12     -10.0085      2.00000
     13      -9.3894      2.00000
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     15      -8.4609      2.00000
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     17      -5.3363      2.00000
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     25       2.9760      0.00000
     26       3.0608      0.00000
     27       3.2617      0.00000
     28       3.4605      0.00000

 k-point   270 :       0.2500   -0.4000    0.3333
  band No.  band energies     occupation 
      1     -24.4327      2.00000
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     10     -12.3451      2.00000
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     13      -9.3193      2.00000
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     16      -8.0690      2.00000
     17      -5.3887      2.00000
     18      -4.9891      2.00000
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     20      -4.3049      2.00000
     21       1.8154      0.00000
     22       1.8330      0.00000
     23       2.8567      0.00000
     24       2.8669      0.00000
     25       3.1360      0.00000
     26       3.2445      0.00000
     27       3.4655      0.00000
     28       3.6289      0.00000

 k-point   271 :       0.3125   -0.4000    0.3333
  band No.  band energies     occupation 
      1     -24.1992      2.00000
      2     -23.1934      2.00000
      3     -21.8347      2.00000
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     11     -10.7999      2.00000
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     15      -8.5546      2.00000
     16      -8.3231      2.00000
     17      -5.4138      2.00000
     18      -5.1655      2.00000
     19      -4.8236      2.00000
     20      -4.5095      2.00000
     21       2.0601      0.00000
     22       2.0747      0.00000
     23       2.8156      0.00000
     24       3.0357      0.00000
     25       3.3511      0.00000
     26       3.5658      0.00000
     27       3.7506      0.00000
     28       3.8306      0.00000

 k-point   272 :       0.3750   -0.4000    0.3333
  band No.  band energies     occupation 
      1     -23.9159      2.00000
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     10     -11.2393      2.00000
     11     -10.5809      2.00000
     12      -9.7905      2.00000
     13      -9.4507      2.00000
     14      -9.1668      2.00000
     15      -8.7118      2.00000
     16      -8.6234      2.00000
     17      -5.3921      2.00000
     18      -5.3055      2.00000
     19      -5.0420      2.00000
     20      -4.7301      2.00000
     21       2.3543      0.00000
     22       2.3817      0.00000
     23       2.8951      0.00000
     24       3.3033      0.00000
     25       3.5903      0.00000
     26       3.9368      0.00000
     27       3.9685      0.00000
     28       4.0444      0.00000

 k-point   273 :       0.4375   -0.4000    0.3333
  band No.  band energies     occupation 
      1     -23.5843      2.00000
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      3     -22.6062      2.00000
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     10     -10.7881      2.00000
     11     -10.4312      2.00000
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     16      -8.8780      2.00000
     17      -5.3743      2.00000
     18      -5.3063      2.00000
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     20      -4.9526      2.00000
     21       2.7154      0.00000
     22       2.7306      0.00000
     23       3.1094      0.00000
     24       3.4484      0.00000
     25       3.7523      0.00000
     26       3.7622      0.00000
     27       4.1601      0.00000
     28       4.1660      0.00000

 k-point   274 :       0.5000   -0.4000    0.3333
  band No.  band energies     occupation 
      1     -23.2070      2.00000
      2     -23.2063      2.00000
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     10     -10.5008      2.00000
     11     -10.3529      2.00000
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     13      -9.2601      2.00000
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     17      -5.3515      2.00000
     18      -5.3488      2.00000
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     20      -5.1532      2.00000
     21       3.0877      0.00000
     22       3.0898      0.00000
     23       3.1147      0.00000
     24       3.1151      0.00000
     25       3.7527      0.00000
     26       3.7531      0.00000
     27       4.0836      0.00000
     28       4.0860      0.00000

 k-point   275 :      -0.4375   -0.4000    0.3333
  band No.  band energies     occupation 
      1     -23.5843      2.00000
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     11     -10.4327      2.00000
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     21       2.7154      0.00000
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     25       3.7527      0.00000
     26       3.7623      0.00000
     27       4.1597      0.00000
     28       4.1662      0.00000

 k-point   276 :      -0.3750   -0.4000    0.3333
  band No.  band energies     occupation 
      1     -23.9159      2.00000
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     25       3.5909      0.00000
     26       3.9368      0.00000
     27       3.9685      0.00000
     28       4.0439      0.00000

 k-point   277 :      -0.3125   -0.4000    0.3333
  band No.  band energies     occupation 
      1     -24.1992      2.00000
      2     -23.1934      2.00000
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     10     -11.8030      2.00000
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     17      -5.4123      2.00000
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     21       2.0600      0.00000
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     24       3.0356      0.00000
     25       3.3519      0.00000
     26       3.5658      0.00000
     27       3.7504      0.00000
     28       3.8304      0.00000

 k-point   278 :      -0.2500   -0.4000    0.3333
  band No.  band energies     occupation 
      1     -24.4327      2.00000
      2     -23.4179      2.00000
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     10     -12.3454      2.00000
     11     -11.0111      2.00000
     12      -9.8994      2.00000
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     17      -5.3872      2.00000
     18      -4.9904      2.00000
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     20      -4.3059      2.00000
     21       1.8158      0.00000
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     23       2.8570      0.00000
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     25       3.1368      0.00000
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     27       3.4655      0.00000
     28       3.6287      0.00000

 k-point   279 :      -0.1875   -0.4000    0.3333
  band No.  band energies     occupation 
      1     -24.6153      2.00000
      2     -23.5939      2.00000
      3     -20.8059      2.00000
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     11     -11.1973      2.00000
     12     -10.0088      2.00000
     13      -9.3891      2.00000
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     16      -7.8979      2.00000
     17      -5.3351      2.00000
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     20      -4.1257      2.00000
     21       1.6128      0.00000
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     25       2.9760      0.00000
     26       3.0613      0.00000
     27       3.2618      0.00000
     28       3.4604      0.00000

 k-point   280 :      -0.1250   -0.4000    0.3333
  band No.  band energies     occupation 
      1     -24.7463      2.00000
      2     -23.7203      2.00000
      3     -20.3235      2.00000
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     10     -11.6727      2.00000
     11     -11.3610      2.00000
     12     -10.1154      2.00000
     13      -9.4537      2.00000
     14      -9.4245      2.00000
     15      -8.4644      2.00000
     16      -7.8093      2.00000
     17      -5.2744      2.00000
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     20      -3.9813      2.00000
     21       1.4696      0.00000
     22       1.5329      0.00000
     23       2.6347      0.00000
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     25       2.8243      0.00000
     26       2.9871      0.00000
     27       3.2090      0.00000
     28       3.3418      0.00000

 k-point   281 :      -0.0625   -0.4000    0.3333
  band No.  band energies     occupation 
      1     -24.8251      2.00000
      2     -23.7965      2.00000
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     10     -11.4975      2.00000
     11     -11.4290      2.00000
     12     -10.2010      2.00000
     13      -9.5174      2.00000
     14      -9.4970      2.00000
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     16      -7.7780      2.00000
     17      -5.2253      2.00000
     18      -4.5802      2.00000
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     20      -3.8869      2.00000
     21       1.3855      0.00000
     22       1.4545      0.00000
     23       2.5590      0.00000
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     25       2.7349      0.00000
     26       2.9071      0.00000
     27       3.1705      0.00000
     28       3.3209      0.00000

 k-point   282 :       0.0000   -0.3333    0.3333
  band No.  band energies     occupation 
      1     -25.1122      2.00000
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     10     -11.9866      2.00000
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     14      -9.4268      2.00000
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     16      -7.6636      2.00000
     17      -5.2952      2.00000
     18      -4.3159      2.00000
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     20      -3.6785      2.00000
     21       1.0766      0.00000
     22       1.1252      0.00000
     23       2.2535      0.00000
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     25       2.6724      0.00000
     26       2.7794      0.00000
     27       2.8854      0.00000
     28       3.1527      0.00000

 k-point   283 :       0.0625   -0.3333    0.3333
  band No.  band energies     occupation 
      1     -25.0857      2.00000
      2     -23.3830      2.00000
      3     -20.1287      2.00000
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     10     -11.9209      2.00000
     11     -11.1823      2.00000
     12      -9.9407      2.00000
     13      -9.6428      2.00000
     14      -9.4169      2.00000
     15      -8.7424      2.00000
     16      -7.6784      2.00000
     17      -5.3066      2.00000
     18      -4.3427      2.00000
     19      -4.2106      2.00000
     20      -3.7105      2.00000
     21       1.1030      0.00000
     22       1.1515      0.00000
     23       2.2895      0.00000
     24       2.4290      0.00000
     25       2.7049      0.00000
     26       2.8248      0.00000
     27       2.9170      0.00000
     28       3.1415      0.00000

 k-point   284 :       0.1250   -0.3333    0.3333
  band No.  band energies     occupation 
      1     -25.0064      2.00000
      2     -23.3083      2.00000
      3     -20.5191      2.00000
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      5     -16.9598      2.00000
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     10     -11.7768      2.00000
     11     -11.3713      2.00000
     12      -9.9010      2.00000
     13      -9.5104      2.00000
     14      -9.3878      2.00000
     15      -8.7611      2.00000
     16      -7.7344      2.00000
     17      -5.3326      2.00000
     18      -4.4297      2.00000
     19      -4.3058      2.00000
     20      -3.8031      2.00000
     21       1.1841      0.00000
     22       1.2297      0.00000
     23       2.3973      0.00000
     24       2.5246      0.00000
     25       2.7976      0.00000
     26       2.9380      0.00000
     27       3.0005      0.00000
     28       3.1229      0.00000

 k-point   285 :       0.1875   -0.3333    0.3333
  band No.  band energies     occupation 
      1     -24.8745      2.00000
      2     -23.1843      2.00000
      3     -21.0151      2.00000
      4     -19.9149      2.00000
      5     -16.9278      2.00000
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      8     -13.2257      2.00000
      9     -12.7967      2.00000
     10     -11.6540      2.00000
     11     -11.5920      2.00000
     12      -9.8341      2.00000
     13      -9.4071      2.00000
     14      -9.3449      2.00000
     15      -8.7590      2.00000
     16      -7.8550      2.00000
     17      -5.3556      2.00000
     18      -4.5832      2.00000
     19      -4.4415      2.00000
     20      -3.9457      2.00000
     21       1.3233      0.00000
     22       1.3585      0.00000
     23       2.5754      0.00000
     24       2.6781      0.00000
     25       2.9315      0.00000
     26       3.0380      0.00000
     27       3.0798      0.00000
     28       3.2109      0.00000

 k-point   286 :       0.2500   -0.3333    0.3333
  band No.  band energies     occupation 
      1     -24.6906      2.00000
      2     -23.0120      2.00000
      3     -21.5423      2.00000
      4     -20.2832      2.00000
      5     -16.8291      2.00000
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      8     -12.8512      2.00000
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     10     -11.9787      2.00000
     11     -11.3589      2.00000
     12      -9.7506      2.00000
     13      -9.4237      2.00000
     14      -9.2968      2.00000
     15      -8.7126      2.00000
     16      -8.0535      2.00000
     17      -5.3584      2.00000
     18      -4.7807      2.00000
     19      -4.6172      2.00000
     20      -4.1242      2.00000
     21       1.5233      0.00000
     22       1.5399      0.00000
     23       2.8137      0.00000
     24       2.8837      0.00000
     25       2.9975      0.00000
     26       3.0906      0.00000
     27       3.2528      0.00000
     28       3.4322      0.00000

 k-point   287 :       0.3125   -0.3333    0.3333
  band No.  band energies     occupation 
      1     -24.4553      2.00000
      2     -22.7927      2.00000
      3     -22.0645      2.00000
      4     -20.6871      2.00000
      5     -16.6623      2.00000
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      8     -12.6235      2.00000
      9     -12.0882      2.00000
     10     -11.7531      2.00000
     11     -11.0596      2.00000
     12      -9.6842      2.00000
     13      -9.5370      2.00000
     14      -9.2502      2.00000
     15      -8.6812      2.00000
     16      -8.3173      2.00000
     17      -5.3291      2.00000
     18      -4.9847      2.00000
     19      -4.8275      2.00000
     20      -4.3254      2.00000
     21       1.7814      0.00000
     22       1.7825      0.00000
     23       2.8860      0.00000
     24       3.0829      0.00000
     25       3.1846      0.00000
     26       3.3376      0.00000
     27       3.5346      0.00000
     28       3.7283      0.00000

 k-point   288 :       0.3750   -0.3333    0.3333
  band No.  band energies     occupation 
      1     -24.1697      2.00000
      2     -22.5634      2.00000
      3     -22.5284      2.00000
      4     -21.0991      2.00000
      5     -16.4334      2.00000
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      7     -14.5987      2.00000
      8     -12.9262      2.00000
      9     -11.6121      2.00000
     10     -11.3429      2.00000
     11     -10.7379      2.00000
     12      -9.7220      2.00000
     13      -9.6370      2.00000
     14      -9.1917      2.00000
     15      -8.7443      2.00000
     16      -8.5966      2.00000
     17      -5.2579      2.00000
     18      -5.1585      2.00000
     19      -5.0401      2.00000
     20      -4.5399      2.00000
     21       2.0899      0.00000
     22       2.0939      0.00000
     23       2.8688      0.00000
     24       3.3739      0.00000
     25       3.5668      0.00000
     26       3.6401      0.00000
     27       3.8346      0.00000
     28       3.9633      0.00000

 k-point   289 :       0.4375   -0.3333    0.3333
  band No.  band energies     occupation 
      1     -23.8353      2.00000
      2     -23.0287      2.00000
      3     -22.2219      2.00000
      4     -21.5001      2.00000
      5     -16.1494      2.00000
      6     -15.4428      2.00000
      7     -14.1695      2.00000
      8     -13.3307      2.00000
      9     -11.0166      2.00000
     10     -11.0151      2.00000
     11     -10.6098      2.00000
     12      -9.9774      2.00000
     13      -9.5386      2.00000
     14      -9.0960      2.00000
     15      -8.9363      2.00000
     16      -8.8182      2.00000
     17      -5.2684      2.00000
     18      -5.2073      2.00000
     19      -5.1359      2.00000
     20      -4.7581      2.00000
     21       2.4473      0.00000
     22       2.4612      0.00000
     23       2.9581      0.00000
     24       3.2838      0.00000
     25       3.6092      0.00000
     26       3.8868      0.00000
     27       4.0243      0.00000
     28       4.0892      0.00000

 k-point   290 :       0.5000   -0.3333    0.3333
  band No.  band energies     occupation 
      1     -23.4544      2.00000
      2     -23.4536      2.00000
      3     -21.8772      2.00000
      4     -21.8771      2.00000
      5     -15.8175      2.00000
      6     -15.8167      2.00000
      7     -13.7488      2.00000
      8     -13.7476      2.00000
      9     -10.7540      2.00000
     10     -10.7525      2.00000
     11     -10.4412      2.00000
     12     -10.4401      2.00000
     13      -9.2367      2.00000
     14      -9.2350      2.00000
     15      -8.9729      2.00000
     16      -8.9717      2.00000
     17      -5.2899      2.00000
     18      -5.2867      2.00000
     19      -4.9648      2.00000
     20      -4.9633      2.00000
     21       2.8113      0.00000
     22       2.8130      0.00000
     23       2.8765      0.00000
     24       2.8770      0.00000
     25       3.6409      0.00000
     26       3.6414      0.00000
     27       4.2084      0.00000
     28       4.2095      0.00000

 k-point   291 :      -0.4375   -0.3333    0.3333
  band No.  band energies     occupation 
      1     -23.8353      2.00000
      2     -23.0287      2.00000
      3     -22.2219      2.00000
      4     -21.5000      2.00000
      5     -16.1497      2.00000
      6     -15.4424      2.00000
      7     -14.1696      2.00000
      8     -13.3305      2.00000
      9     -11.0163      2.00000
     10     -11.0150      2.00000
     11     -10.6103      2.00000
     12      -9.9778      2.00000
     13      -9.5399      2.00000
     14      -9.0964      2.00000
     15      -8.9352      2.00000
     16      -8.8174      2.00000
     17      -5.2703      2.00000
     18      -5.2055      2.00000
     19      -5.1346      2.00000
     20      -4.7593      2.00000
     21       2.4474      0.00000
     22       2.4613      0.00000
     23       2.9584      0.00000
     24       3.2836      0.00000
     25       3.6092      0.00000
     26       3.8867      0.00000
     27       4.0245      0.00000
     28       4.0891      0.00000

 k-point   292 :      -0.3750   -0.3333    0.3333
  band No.  band energies     occupation 
      1     -24.1697      2.00000
      2     -22.5634      2.00000
      3     -22.5284      2.00000
      4     -21.0991      2.00000
      5     -16.4337      2.00000
      6     -15.0331      2.00000
      7     -14.5988      2.00000
      8     -12.9258      2.00000
      9     -11.6122      2.00000
     10     -11.3422      2.00000
     11     -10.7392      2.00000
     12      -9.7229      2.00000
     13      -9.6377      2.00000
     14      -9.1915      2.00000
     15      -8.7434      2.00000
     16      -8.5959      2.00000
     17      -5.2565      2.00000
     18      -5.1603      2.00000
     19      -5.0386      2.00000
     20      -4.5411      2.00000
     21       2.0899      0.00000
     22       2.0941      0.00000
     23       2.8690      0.00000
     24       3.3739      0.00000
     25       3.5668      0.00000
     26       3.6403      0.00000
     27       3.8349      0.00000
     28       3.9636      0.00000

 k-point   293 :      -0.3125   -0.3333    0.3333
  band No.  band energies     occupation 
      1     -24.4553      2.00000
      2     -22.7927      2.00000
      3     -22.0645      2.00000
      4     -20.6871      2.00000
      5     -16.6626      2.00000
      6     -15.0466      2.00000
      7     -14.5979      2.00000
      8     -12.6228      2.00000
      9     -12.0886      2.00000
     10     -11.7522      2.00000
     11     -11.0615      2.00000
     12      -9.6855      2.00000
     13      -9.5371      2.00000
     14      -9.2495      2.00000
     15      -8.6807      2.00000
     16      -8.3168      2.00000
     17      -5.3277      2.00000
     18      -4.9862      2.00000
     19      -4.8263      2.00000
     20      -4.3264      2.00000
     21       1.7814      0.00000
     22       1.7827      0.00000
     23       2.8862      0.00000
     24       3.0828      0.00000
     25       3.1845      0.00000
     26       3.3381      0.00000
     27       3.5353      0.00000
     28       3.7286      0.00000

 k-point   294 :      -0.2500   -0.3333    0.3333
  band No.  band energies     occupation 
      1     -24.6906      2.00000
      2     -23.0120      2.00000
      3     -21.5423      2.00000
      4     -20.2831      2.00000
      5     -16.8294      2.00000
      6     -15.5232      2.00000
      7     -14.1493      2.00000
      8     -12.8509      2.00000
      9     -12.2581      2.00000
     10     -11.9787      2.00000
     11     -11.3610      2.00000
     12      -9.7521      2.00000
     13      -9.4233      2.00000
     14      -9.2957      2.00000
     15      -8.7126      2.00000
     16      -8.0531      2.00000
     17      -5.3570      2.00000
     18      -4.7820      2.00000
     19      -4.6162      2.00000
     20      -4.1251      2.00000
     21       1.5236      0.00000
     22       1.5399      0.00000
     23       2.8137      0.00000
     24       2.8837      0.00000
     25       2.9977      0.00000
     26       3.0908      0.00000
     27       3.2535      0.00000
     28       3.4328      0.00000

 k-point   295 :      -0.1875   -0.3333    0.3333
  band No.  band energies     occupation 
      1     -24.8745      2.00000
      2     -23.1843      2.00000
      3     -21.0151      2.00000
      4     -19.9148      2.00000
      5     -16.9280      2.00000
      6     -16.0247      2.00000
      7     -13.7061      2.00000
      8     -13.2255      2.00000
      9     -12.7961      2.00000
     10     -11.6538      2.00000
     11     -11.5940      2.00000
     12      -9.8357      2.00000
     13      -9.4061      2.00000
     14      -9.3437      2.00000
     15      -8.7595      2.00000
     16      -7.8548      2.00000
     17      -5.3544      2.00000
     18      -4.5841      2.00000
     19      -4.4408      2.00000
     20      -3.9464      2.00000
     21       1.3236      0.00000
     22       1.3585      0.00000
     23       2.5754      0.00000
     24       2.6781      0.00000
     25       2.9314      0.00000
     26       3.0380      0.00000
     27       3.0800      0.00000
     28       3.2117      0.00000

 k-point   296 :      -0.1250   -0.3333    0.3333
  band No.  band energies     occupation 
      1     -25.0064      2.00000
      2     -23.3083      2.00000
      3     -20.5191      2.00000
      4     -19.6171      2.00000
      5     -16.9600      2.00000
      6     -16.5153      2.00000
      7     -13.5042      2.00000
      8     -13.3052      2.00000
      9     -13.2726      2.00000
     10     -11.7787      2.00000
     11     -11.3710      2.00000
     12      -9.9025      2.00000
     13      -9.5094      2.00000
     14      -9.3868      2.00000
     15      -8.7617      2.00000
     16      -7.7342      2.00000
     17      -5.3318      2.00000
     18      -4.4302      2.00000
     19      -4.3054      2.00000
     20      -3.8036      2.00000
     21       1.1842      0.00000
     22       1.2297      0.00000
     23       2.3974      0.00000
     24       2.5247      0.00000
     25       2.7979      0.00000
     26       2.9373      0.00000
     27       3.0009      0.00000
     28       3.1233      0.00000

 k-point   297 :      -0.0625   -0.3333    0.3333
  band No.  band energies     occupation 
      1     -25.0857      2.00000
      2     -23.3830      2.00000
      3     -20.1287      2.00000
      4     -19.4241      2.00000
      5     -16.9473      2.00000
      6     -16.9101      2.00000
      7     -13.6692      2.00000
      8     -13.6254      2.00000
      9     -12.9776      2.00000
     10     -11.9223      2.00000
     11     -11.1820      2.00000
     12      -9.9415      2.00000
     13      -9.6421      2.00000
     14      -9.4162      2.00000
     15      -8.7427      2.00000
     16      -7.6783      2.00000
     17      -5.3061      2.00000
     18      -4.3428      2.00000
     19      -4.2105      2.00000
     20      -3.7108      2.00000
     21       1.1031      0.00000
     22       1.1515      0.00000
     23       2.2895      0.00000
     24       2.4291      0.00000
     25       2.7051      0.00000
     26       2.8244      0.00000
     27       2.9173      0.00000
     28       3.1413      0.00000

 k-point   298 :       0.0000   -0.2667    0.3333
  band No.  band energies     occupation 
      1     -25.3279      2.00000
      2     -22.9675      2.00000
      3     -20.1267      2.00000
      4     -19.4868      2.00000
      5     -17.1216      2.00000
      6     -16.7502      2.00000
      7     -13.5491      2.00000
      8     -13.4700      2.00000
      9     -13.2955      2.00000
     10     -12.3423      2.00000
     11     -10.9884      2.00000
     12      -9.9455      2.00000
     13      -9.8525      2.00000
     14      -9.1994      2.00000
     15      -8.9446      2.00000
     16      -7.6224      2.00000
     17      -5.3040      2.00000
     18      -4.1927      2.00000
     19      -4.0438      2.00000
     20      -3.5097      2.00000
     21       0.8497      0.00000
     22       0.8961      0.00000
     23       1.9355      0.00000
     24       2.1149      0.00000
     25       2.4296      0.00000
     26       2.6541      0.00000
     27       2.7245      0.00000
     28       3.0266      0.00000

 k-point   299 :       0.0625   -0.2667    0.3333
  band No.  band energies     occupation 
      1     -25.3013      2.00000
      2     -22.9432      2.00000
      3     -20.2888      2.00000
      4     -19.5219      2.00000
      5     -16.9454      2.00000
      6     -16.8037      2.00000
      7     -13.4540      2.00000
      8     -13.4271      2.00000
      9     -13.3960      2.00000
     10     -12.2727      2.00000
     11     -11.0258      2.00000
     12      -9.8685      2.00000
     13      -9.8581      2.00000
     14      -9.2024      2.00000
     15      -8.9697      2.00000
     16      -7.6453      2.00000
     17      -5.3072      2.00000
     18      -4.2140      2.00000
     19      -4.0863      2.00000
     20      -3.5400      2.00000
     21       0.8749      0.00000
     22       0.9231      0.00000
     23       1.9717      0.00000
     24       2.1484      0.00000
     25       2.4618      0.00000
     26       2.6853      0.00000
     27       2.7849      0.00000
     28       3.0383      0.00000

 k-point   300 :       0.1250   -0.2667    0.3333
  band No.  band energies     occupation 
      1     -25.2216      2.00000
      2     -22.8704      2.00000
      3     -20.6882      2.00000
      4     -19.6322      2.00000
      5     -16.9189      2.00000
      6     -16.5079      2.00000
      7     -13.7517      2.00000
      8     -13.2968      2.00000
      9     -13.0881      2.00000
     10     -12.1051      2.00000
     11     -11.1448      2.00000
     12      -9.8624      2.00000
     13      -9.6809      2.00000
     14      -9.2065      2.00000
     15      -9.0347      2.00000
     16      -7.7219      2.00000
     17      -5.3100      2.00000
     18      -4.2816      2.00000
     19      -4.2073      2.00000
     20      -3.6281      2.00000
     21       0.9527      0.00000
     22       1.0036      0.00000
     23       2.0802      0.00000
     24       2.2487      0.00000
     25       2.5578      0.00000
     26       2.7740      0.00000
     27       2.9428      0.00000
     28       3.0685      0.00000

 k-point   301 :       0.1875   -0.2667    0.3333
  band No.  band energies     occupation 
      1     -25.0891      2.00000
      2     -22.7498      2.00000
      3     -21.1935      2.00000
      4     -19.8251      2.00000
      5     -17.0110      2.00000
      6     -15.9518      2.00000
      7     -14.1603      2.00000
      8     -13.0758      2.00000
      9     -12.6652      2.00000
     10     -11.8551      2.00000
     11     -11.3521      2.00000
     12      -9.8395      2.00000
     13      -9.5207      2.00000
     14      -9.2090      2.00000
     15      -9.0720      2.00000
     16      -7.8653      2.00000
     17      -5.2979      2.00000
     18      -4.4068      2.00000
     19      -4.3862      2.00000
     20      -3.7653      2.00000
     21       1.0876      0.00000
     22       1.1383      0.00000
     23       2.2609      0.00000
     24       2.4144      0.00000
     25       2.7152      0.00000
     26       2.9171      0.00000
     27       3.1023      0.00000
     28       3.1478      0.00000

 k-point   302 :       0.2500   -0.2667    0.3333
  band No.  band energies     occupation 
      1     -24.9041      2.00000
      2     -22.5825      2.00000
      3     -21.7286      2.00000
      4     -20.0962      2.00000
      5     -17.0242      2.00000
      6     -15.3692      2.00000
      7     -14.6031      2.00000
      8     -12.7701      2.00000
      9     -12.2617      2.00000
     10     -11.6251      2.00000
     11     -11.4951      2.00000
     12      -9.7811      2.00000
     13      -9.5698      2.00000
     14      -9.2190      2.00000
     15      -8.9606      2.00000
     16      -8.0758      2.00000
     17      -5.2582      2.00000
     18      -4.6093      2.00000
     19      -4.5795      2.00000
     20      -3.9383      2.00000
     21       1.2836      0.00000
     22       1.3306      0.00000
     23       2.5134      0.00000
     24       2.6449      0.00000
     25       2.9312      0.00000
     26       3.0813      0.00000
     27       3.1553      0.00000
     28       3.3197      0.00000

 k-point   303 :       0.3125   -0.2667    0.3333
  band No.  band energies     occupation 
      1     -24.6675      2.00000
      2     -22.3703      2.00000
      3     -22.2573      2.00000
      4     -20.4246      2.00000
      5     -16.9429      2.00000
      6     -15.0483      2.00000
      7     -14.8097      2.00000
      8     -12.4719      2.00000
      9     -11.9232      2.00000
     10     -11.8467      2.00000
     11     -11.0649      2.00000
     12      -9.7222      2.00000
     13      -9.7199      2.00000
     14      -9.2464      2.00000
     15      -8.8261      2.00000
     16      -8.3301      2.00000
     17      -5.1849      2.00000
     18      -4.8311      2.00000
     19      -4.7958      2.00000
     20      -4.1331      2.00000
     21       1.5407      0.00000
     22       1.5868      0.00000
     23       2.8348      0.00000
     24       2.9298      0.00000
     25       2.9706      0.00000
     26       3.2333      0.00000
     27       3.4203      0.00000
     28       3.5732      0.00000

 k-point   304 :       0.3750   -0.2667    0.3333
  band No.  band energies     occupation 
      1     -24.3802      2.00000
      2     -22.7614      2.00000
      3     -22.1157      2.00000
      4     -20.7826      2.00000
      5     -16.7746      2.00000
      6     -15.4762      2.00000
      7     -14.2929      2.00000
      8     -12.5825      2.00000
      9     -11.6186      2.00000
     10     -11.6102      2.00000
     11     -10.7630      2.00000
     12      -9.7777      2.00000
     13      -9.7612      2.00000
     14      -9.2417      2.00000
     15      -8.7971      2.00000
     16      -8.5816      2.00000
     17      -5.0761      2.00000
     18      -5.0281      2.00000
     19      -5.0029      2.00000
     20      -4.3389      2.00000
     21       1.8537      0.00000
     22       1.9100      0.00000
     23       2.8509      0.00000
     24       3.2296      0.00000
     25       3.3086      0.00000
     26       3.5263      0.00000
     27       3.6613      0.00000
     28       3.8073      0.00000

 k-point   305 :       0.4375   -0.2667    0.3333
  band No.  band energies     occupation 
      1     -24.0436      2.00000
      2     -23.2309      2.00000
      3     -21.8227      2.00000
      4     -21.1460      2.00000
      5     -16.5322      2.00000
      6     -15.8731      2.00000
      7     -13.8166      2.00000
      8     -12.9510      2.00000
      9     -11.3222      2.00000
     10     -11.0911      2.00000
     11     -10.8026      2.00000
     12     -10.0753      2.00000
     13      -9.5172      2.00000
     14      -9.1351      2.00000
     15      -8.9161      2.00000
     16      -8.7940      2.00000
     17      -5.1650      2.00000
     18      -5.1518      2.00000
     19      -4.9300      2.00000
     20      -4.5477      2.00000
     21       2.2106      0.00000
     22       2.2955      0.00000
     23       2.8140      0.00000
     24       3.1798      0.00000
     25       3.4448      0.00000
     26       3.6911      0.00000
     27       3.7624      0.00000
     28       3.8718      0.00000

 k-point   306 :       0.5000   -0.2667    0.3333
  band No.  band energies     occupation 
      1     -23.6600      2.00000
      2     -23.6592      2.00000
      3     -21.4968      2.00000
      4     -21.4966      2.00000
      5     -16.2289      2.00000
      6     -16.2277      2.00000
      7     -13.3714      2.00000
      8     -13.3699      2.00000
      9     -11.0375      2.00000
     10     -11.0361      2.00000
     11     -10.5472      2.00000
     12     -10.5460      2.00000
     13      -9.1774      2.00000
     14      -9.1759      2.00000
     15      -8.9759      2.00000
     16      -8.9747      2.00000
     17      -5.2118      2.00000
     18      -5.2081      2.00000
     19      -4.7506      2.00000
     20      -4.7488      2.00000
     21       2.5807      0.00000
     22       2.5820      0.00000
     23       2.7292      0.00000
     24       2.7302      0.00000
     25       3.4885      0.00000
     26       3.4892      0.00000
     27       4.1324      0.00000
     28       4.1332      0.00000

 k-point   307 :      -0.4375   -0.2667    0.3333
  band No.  band energies     occupation 
      1     -24.0436      2.00000
      2     -23.2309      2.00000
      3     -21.8227      2.00000
      4     -21.1459      2.00000
      5     -16.5326      2.00000
      6     -15.8726      2.00000
      7     -13.8169      2.00000
      8     -12.9506      2.00000
      9     -11.3223      2.00000
     10     -11.0910      2.00000
     11     -10.8024      2.00000
     12     -10.0759      2.00000
     13      -9.5186      2.00000
     14      -9.1355      2.00000
     15      -8.9149      2.00000
     16      -8.7933      2.00000
     17      -5.1674      2.00000
     18      -5.1495      2.00000
     19      -4.9288      2.00000
     20      -4.5488      2.00000
     21       2.2108      0.00000
     22       2.2956      0.00000
     23       2.8142      0.00000
     24       3.1795      0.00000
     25       3.4445      0.00000
     26       3.6913      0.00000
     27       3.7627      0.00000
     28       3.8716      0.00000

 k-point   308 :      -0.3750   -0.2667    0.3333
  band No.  band energies     occupation 
      1     -24.3802      2.00000
      2     -22.7614      2.00000
      3     -22.1158      2.00000
      4     -20.7826      2.00000
      5     -16.7750      2.00000
      6     -15.4756      2.00000
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     10     -11.6104      2.00000
     11     -10.7632      2.00000
     12      -9.7789      2.00000
     13      -9.7623      2.00000
     14      -9.2413      2.00000
     15      -8.7961      2.00000
     16      -8.5808      2.00000
     17      -5.0748      2.00000
     18      -5.0305      2.00000
     19      -5.0008      2.00000
     20      -4.3399      2.00000
     21       1.8540      0.00000
     22       1.9101      0.00000
     23       2.8511      0.00000
     24       3.2297      0.00000
     25       3.3088      0.00000
     26       3.5260      0.00000
     27       3.6610      0.00000
     28       3.8078      0.00000

 k-point   309 :      -0.3125   -0.2667    0.3333
  band No.  band energies     occupation 
      1     -24.6675      2.00000
      2     -22.3703      2.00000
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     10     -11.8470      2.00000
     11     -11.0661      2.00000
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     13      -9.7214      2.00000
     14      -9.2454      2.00000
     15      -8.8254      2.00000
     16      -8.3295      2.00000
     17      -5.1836      2.00000
     18      -4.8330      2.00000
     19      -4.7943      2.00000
     20      -4.1341      2.00000
     21       1.5410      0.00000
     22       1.5869      0.00000
     23       2.8348      0.00000
     24       2.9304      0.00000
     25       2.9704      0.00000
     26       3.2334      0.00000
     27       3.4200      0.00000
     28       3.5740      0.00000

 k-point   310 :      -0.2500   -0.2667    0.3333
  band No.  band energies     occupation 
      1     -24.9041      2.00000
      2     -22.5825      2.00000
      3     -21.7286      2.00000
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     10     -11.6248      2.00000
     11     -11.4970      2.00000
     12      -9.7830      2.00000
     13      -9.5695      2.00000
     14      -9.2180      2.00000
     15      -8.9603      2.00000
     16      -8.0753      2.00000
     17      -5.2569      2.00000
     18      -4.6106      2.00000
     19      -4.5785      2.00000
     20      -3.9392      2.00000
     21       1.2838      0.00000
     22       1.3307      0.00000
     23       2.5134      0.00000
     24       2.6450      0.00000
     25       2.9313      0.00000
     26       3.0820      0.00000
     27       3.1546      0.00000
     28       3.3206      0.00000

 k-point   311 :      -0.1875   -0.2667    0.3333
  band No.  band energies     occupation 
      1     -25.0891      2.00000
      2     -22.7498      2.00000
      3     -21.1935      2.00000
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     10     -11.8574      2.00000
     11     -11.3517      2.00000
     12      -9.8413      2.00000
     13      -9.5196      2.00000
     14      -9.2080      2.00000
     15      -9.0726      2.00000
     16      -7.8650      2.00000
     17      -5.2968      2.00000
     18      -4.4066      2.00000
     19      -4.3866      2.00000
     20      -3.7660      2.00000
     21       1.0879      0.00000
     22       1.1383      0.00000
     23       2.2609      0.00000
     24       2.4145      0.00000
     25       2.7153      0.00000
     26       2.9170      0.00000
     27       3.1023      0.00000
     28       3.1483      0.00000

 k-point   312 :      -0.1250   -0.2667    0.3333
  band No.  band energies     occupation 
      1     -25.2216      2.00000
      2     -22.8704      2.00000
      3     -20.6883      2.00000
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      9     -13.0876      2.00000
     10     -12.1072      2.00000
     11     -11.1443      2.00000
     12      -9.8640      2.00000
     13      -9.6799      2.00000
     14      -9.2056      2.00000
     15      -9.0353      2.00000
     16      -7.7217      2.00000
     17      -5.3093      2.00000
     18      -4.2812      2.00000
     19      -4.2078      2.00000
     20      -3.6286      2.00000
     21       0.9529      0.00000
     22       1.0037      0.00000
     23       2.0802      0.00000
     24       2.2488      0.00000
     25       2.5579      0.00000
     26       2.7740      0.00000
     27       2.9428      0.00000
     28       3.0683      0.00000

 k-point   313 :      -0.0625   -0.2667    0.3333
  band No.  band energies     occupation 
      1     -25.3013      2.00000
      2     -22.9432      2.00000
      3     -20.2888      2.00000
      4     -19.5219      2.00000
      5     -16.9454      2.00000
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      7     -13.4527      2.00000
      8     -13.4271      2.00000
      9     -13.3961      2.00000
     10     -12.2741      2.00000
     11     -11.0255      2.00000
     12      -9.8679      2.00000
     13      -9.8589      2.00000
     14      -9.2019      2.00000
     15      -8.9701      2.00000
     16      -7.6452      2.00000
     17      -5.3068      2.00000
     18      -4.2138      2.00000
     19      -4.0866      2.00000
     20      -3.5402      2.00000
     21       0.8750      0.00000
     22       0.9231      0.00000
     23       1.9717      0.00000
     24       2.1485      0.00000
     25       2.4619      0.00000
     26       2.6852      0.00000
     27       2.7850      0.00000
     28       3.0380      0.00000

 k-point   314 :       0.0000   -0.2000    0.3333
  band No.  band energies     occupation 
      1     -25.4972      2.00000
      2     -22.5093      2.00000
      3     -20.2543      2.00000
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     10     -12.5513      2.00000
     11     -10.9478      2.00000
     12     -10.2634      2.00000
     13      -9.8424      2.00000
     14      -9.1047      2.00000
     15      -8.9352      2.00000
     16      -7.6253      2.00000
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     20      -3.3650      2.00000
     21       0.6810      0.00000
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     23       1.6879      0.00000
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     25       2.2213      0.00000
     26       2.5201      0.00000
     27       2.6286      0.00000
     28       2.8140      0.00000

 k-point   315 :       0.0625   -0.2000    0.3333
  band No.  band energies     occupation 
      1     -25.4705      2.00000
      2     -22.4858      2.00000
      3     -20.4193      2.00000
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     10     -12.4628      2.00000
     11     -10.9593      2.00000
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     13      -9.8567      2.00000
     14      -9.1417      2.00000
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     16      -7.6550      2.00000
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     18      -4.1525      2.00000
     19      -3.9371      2.00000
     20      -3.3930      2.00000
     21       0.7052      0.00000
     22       0.7666      0.00000
     23       1.7241      0.00000
     24       1.9257      0.00000
     25       2.2543      0.00000
     26       2.5490      0.00000
     27       2.6980      0.00000
     28       2.8579      0.00000

 k-point   316 :       0.1250   -0.2000    0.3333
  band No.  band energies     occupation 
      1     -25.3904      2.00000
      2     -22.4156      2.00000
      3     -20.8246      2.00000
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     10     -12.2203      2.00000
     11     -11.0056      2.00000
     12      -9.9384      2.00000
     13      -9.8902      2.00000
     14      -9.2454      2.00000
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     16      -7.7471      2.00000
     17      -5.2344      2.00000
     18      -4.2271      2.00000
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     20      -3.4752      2.00000
     21       0.7798      0.00000
     22       0.8509      0.00000
     23       1.8327      0.00000
     24       2.0290      0.00000
     25       2.3535      0.00000
     26       2.6359      0.00000
     27       2.8805      0.00000
     28       2.9821      0.00000

 k-point   317 :       0.1875   -0.2000    0.3333
  band No.  band energies     occupation 
      1     -25.2574      2.00000
      2     -22.2995      2.00000
      3     -21.3361      2.00000
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     10     -11.8388      2.00000
     11     -11.1160      2.00000
     12      -9.9127      2.00000
     13      -9.6840      2.00000
     14      -9.3580      2.00000
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     17      -5.1937      2.00000
     18      -4.3641      2.00000
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     20      -3.6044      2.00000
     21       0.9104      0.00000
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     23       2.0140      0.00000
     24       2.2012      0.00000
     25       2.5194      0.00000
     26       2.7828      0.00000
     27       3.0870      0.00000
     28       3.1727      0.00000

 k-point   318 :       0.2500   -0.2000    0.3333
  band No.  band energies     occupation 
      1     -25.0717      2.00000
      2     -22.1392      2.00000
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     10     -11.3684      2.00000
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     14      -9.2151      2.00000
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     18      -4.5605      2.00000
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     20      -3.7690      2.00000
     21       1.1019      0.00000
     22       1.1975      0.00000
     23       2.2680      0.00000
     24       2.4431      0.00000
     25       2.7516      0.00000
     26       2.9933      0.00000
     27       3.1728      0.00000
     28       3.4161      0.00000

 k-point   319 :       0.3125   -0.2000    0.3333
  band No.  band energies     occupation 
      1     -24.8341      2.00000
      2     -22.4099      2.00000
      3     -21.9370      2.00000
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     10     -11.5194      2.00000
     11     -10.9431      2.00000
     12      -9.8640      2.00000
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     14      -9.2645      2.00000
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     16      -8.3467      2.00000
     17      -5.0161      2.00000
     18      -4.7854      2.00000
     19      -4.6975      2.00000
     20      -3.9550      2.00000
     21       1.3559      0.00000
     22       1.4687      0.00000
     23       2.5943      0.00000
     24       2.7546      0.00000
     25       2.9937      0.00000
     26       3.1034      0.00000
     27       3.2979      0.00000
     28       3.6867      0.00000

 k-point   320 :       0.3750   -0.2000    0.3333
  band No.  band energies     occupation 
      1     -24.5455      2.00000
      2     -22.9177      2.00000
      3     -21.6967      2.00000
      4     -20.5156      2.00000
      5     -17.0573      2.00000
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     10     -11.5020      2.00000
     11     -10.8170      2.00000
     12      -9.9228      2.00000
     13      -9.7649      2.00000
     14      -9.3086      2.00000
     15      -8.8752      2.00000
     16      -8.5791      2.00000
     17      -4.9889      2.00000
     18      -4.9110      2.00000
     19      -4.8812      2.00000
     20      -4.1504      2.00000
     21       1.6683      0.00000
     22       1.8077      0.00000
     23       2.8550      0.00000
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     25       3.1400      0.00000
     26       3.4268      0.00000
     27       3.5759      0.00000
     28       3.6549      0.00000

 k-point   321 :       0.4375   -0.2000    0.3333
  band No.  band energies     occupation 
      1     -24.2073      2.00000
      2     -23.3902      2.00000
      3     -21.4239      2.00000
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      8     -12.6131      2.00000
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     10     -11.1284      2.00000
     11     -11.0086      2.00000
     12     -10.2190      2.00000
     13      -9.4301      2.00000
     14      -9.2008      2.00000
     15      -8.9128      2.00000
     16      -8.8003      2.00000
     17      -5.1200      2.00000
     18      -5.0708      2.00000
     19      -4.7210      2.00000
     20      -4.3472      2.00000
     21       2.0272      0.00000
     22       2.2097      0.00000
     23       2.7039      0.00000
     24       3.1501      0.00000
     25       3.3061      0.00000
     26       3.4724      0.00000
     27       3.5888      0.00000
     28       3.6816      0.00000

 k-point   322 :       0.5000   -0.2000    0.3333
  band No.  band energies     occupation 
      1     -23.8218      2.00000
      2     -23.8209      2.00000
      3     -21.1272      2.00000
      4     -21.1266      2.00000
      5     -16.6179      2.00000
      6     -16.6161      2.00000
      7     -13.0300      2.00000
      8     -13.0282      2.00000
      9     -11.2998      2.00000
     10     -11.2985      2.00000
     11     -10.6571      2.00000
     12     -10.6559      2.00000
     13      -9.1104      2.00000
     14      -9.1090      2.00000
     15      -9.0132      2.00000
     16      -9.0118      2.00000
     17      -5.1494      2.00000
     18      -5.1454      2.00000
     19      -4.5413      2.00000
     20      -4.5391      2.00000
     21       2.4040      0.00000
     22       2.4048      0.00000
     23       2.6638      0.00000
     24       2.6652      0.00000
     25       3.3482      0.00000
     26       3.3489      0.00000
     27       4.0036      0.00000
     28       4.0039      0.00000

 k-point   323 :      -0.4375   -0.2000    0.3333
  band No.  band energies     occupation 
      1     -24.2073      2.00000
      2     -23.3902      2.00000
      3     -21.4239      2.00000
      4     -20.8181      2.00000
      5     -16.8785      2.00000
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      8     -12.6124      2.00000
      9     -11.6062      2.00000
     10     -11.1285      2.00000
     11     -11.0083      2.00000
     12     -10.2196      2.00000
     13      -9.4315      2.00000
     14      -9.2012      2.00000
     15      -8.9116      2.00000
     16      -8.7996      2.00000
     17      -5.1199      2.00000
     18      -5.0709      2.00000
     19      -4.7200      2.00000
     20      -4.3482      2.00000
     21       2.0274      0.00000
     22       2.2099      0.00000
     23       2.7041      0.00000
     24       3.1498      0.00000
     25       3.3057      0.00000
     26       3.4725      0.00000
     27       3.5891      0.00000
     28       3.6817      0.00000

 k-point   324 :      -0.3750   -0.2000    0.3333
  band No.  band energies     occupation 
      1     -24.5455      2.00000
      2     -22.9177      2.00000
      3     -21.6967      2.00000
      4     -20.5155      2.00000
      5     -17.0578      2.00000
      6     -15.9118      2.00000
      7     -14.0420      2.00000
      8     -12.3202      2.00000
      9     -11.9045      2.00000
     10     -11.5023      2.00000
     11     -10.8168      2.00000
     12      -9.9240      2.00000
     13      -9.7663      2.00000
     14      -9.3085      2.00000
     15      -8.8742      2.00000
     16      -8.5783      2.00000
     17      -4.9888      2.00000
     18      -4.9112      2.00000
     19      -4.8801      2.00000
     20      -4.1513      2.00000
     21       1.6686      0.00000
     22       1.8078      0.00000
     23       2.8553      0.00000
     24       2.9985      0.00000
     25       3.1401      0.00000
     26       3.4267      0.00000
     27       3.5764      0.00000
     28       3.6544      0.00000

 k-point   325 :      -0.3125   -0.2000    0.3333
  band No.  band energies     occupation 
      1     -24.8341      2.00000
      2     -22.4099      2.00000
      3     -21.9370      2.00000
      4     -20.2429      2.00000
      5     -17.1367      2.00000
      6     -15.4957      2.00000
      7     -14.6351      2.00000
      8     -12.3706      2.00000
      9     -12.1864      2.00000
     10     -11.5194      2.00000
     11     -10.9435      2.00000
     12      -9.8648      2.00000
     13      -9.8566      2.00000
     14      -9.2639      2.00000
     15      -8.9909      2.00000
     16      -8.3461      2.00000
     17      -5.0150      2.00000
     18      -4.7853      2.00000
     19      -4.6979      2.00000
     20      -3.9559      2.00000
     21       1.3561      0.00000
     22       1.4688      0.00000
     23       2.5944      0.00000
     24       2.7548      0.00000
     25       2.9939      0.00000
     26       3.1038      0.00000
     27       3.2980      0.00000
     28       3.6878      0.00000

 k-point   326 :      -0.2500   -0.2000    0.3333
  band No.  band energies     occupation 
      1     -25.0717      2.00000
      2     -22.1392      2.00000
      3     -21.8766      2.00000
      4     -20.0245      2.00000
      5     -17.1017      2.00000
      6     -15.2723      2.00000
      7     -15.0568      2.00000
      8     -12.6336      2.00000
      9     -12.4551      2.00000
     10     -11.3696      2.00000
     11     -11.3053      2.00000
     12      -9.8959      2.00000
     13      -9.7227      2.00000
     14      -9.2146      2.00000
     15      -9.1623      2.00000
     16      -8.1116      2.00000
     17      -5.1203      2.00000
     18      -4.5602      2.00000
     19      -4.4648      2.00000
     20      -3.7697      2.00000
     21       1.1021      0.00000
     22       1.1976      0.00000
     23       2.2680      0.00000
     24       2.4432      0.00000
     25       2.7517      0.00000
     26       2.9936      0.00000
     27       3.1731      0.00000
     28       3.4160      0.00000

 k-point   327 :      -0.1875   -0.2000    0.3333
  band No.  band energies     occupation 
      1     -25.2574      2.00000
      2     -22.2995      2.00000
      3     -21.3361      2.00000
      4     -19.8740      2.00000
      5     -16.9588      2.00000
      6     -15.9201      2.00000
      7     -14.6164      2.00000
      8     -12.8743      2.00000
      9     -12.7261      2.00000
     10     -11.8404      2.00000
     11     -11.1154      2.00000
     12      -9.9143      2.00000
     13      -9.6828      2.00000
     14      -9.3586      2.00000
     15      -9.0792      2.00000
     16      -7.9029      2.00000
     17      -5.1928      2.00000
     18      -4.3636      2.00000
     19      -4.2439      2.00000
     20      -3.6049      2.00000
     21       0.9106      0.00000
     22       0.9932      0.00000
     23       2.0140      0.00000
     24       2.2013      0.00000
     25       2.5194      0.00000
     26       2.7829      0.00000
     27       3.0869      0.00000
     28       3.1726      0.00000

 k-point   328 :      -0.1250   -0.2000    0.3333
  band No.  band energies     occupation 
      1     -25.3904      2.00000
      2     -22.4156      2.00000
      3     -20.8246      2.00000
      4     -19.7863      2.00000
      5     -16.7492      2.00000
      6     -16.5232      2.00000
      7     -14.2079      2.00000
      8     -13.0491      2.00000
      9     -13.0134      2.00000
     10     -12.2221      2.00000
     11     -11.0051      2.00000
     12      -9.9375      2.00000
     13      -9.8914      2.00000
     14      -9.2459      2.00000
     15      -9.0107      2.00000
     16      -7.7469      2.00000
     17      -5.2337      2.00000
     18      -4.2267      2.00000
     19      -4.0603      2.00000
     20      -3.4756      2.00000
     21       0.7799      0.00000
     22       0.8509      0.00000
     23       1.8327      0.00000
     24       2.0290      0.00000
     25       2.3535      0.00000
     26       2.6360      0.00000
     27       2.8802      0.00000
     28       2.9819      0.00000

 k-point   329 :      -0.0625   -0.2000    0.3333
  band No.  band energies     occupation 
      1     -25.4705      2.00000
      2     -22.4858      2.00000
      3     -20.4193      2.00000
      4     -19.7443      2.00000
      5     -16.9897      2.00000
      6     -16.5527      2.00000
      7     -13.8900      2.00000
      8     -13.2706      2.00000
      9     -13.1533      2.00000
     10     -12.4641      2.00000
     11     -10.9590      2.00000
     12     -10.1718      2.00000
     13      -9.8573      2.00000
     14      -9.1419      2.00000
     15      -8.9569      2.00000
     16      -7.6549      2.00000
     17      -5.2511      2.00000
     18      -4.1523      2.00000
     19      -3.9374      2.00000
     20      -3.3932      2.00000
     21       0.7052      0.00000
     22       0.7666      0.00000
     23       1.7241      0.00000
     24       1.9257      0.00000
     25       2.2543      0.00000
     26       2.5490      0.00000
     27       2.6979      0.00000
     28       2.8578      0.00000

 k-point   330 :       0.0000   -0.1333    0.3333
  band No.  band energies     occupation 
      1     -25.6188      2.00000
      2     -22.0477      2.00000
      3     -20.3485      2.00000
      4     -20.0600      2.00000
      5     -17.2228      2.00000
      6     -16.1208      2.00000
      7     -14.2128      2.00000
      8     -13.3736      2.00000
      9     -12.9185      2.00000
     10     -12.5110      2.00000
     11     -10.9668      2.00000
     12     -10.6035      2.00000
     13      -9.8687      2.00000
     14      -9.2195      2.00000
     15      -8.7043      2.00000
     16      -7.6507      2.00000
     17      -5.1838      2.00000
     18      -4.0829      2.00000
     19      -3.7932      2.00000
     20      -3.2562      2.00000
     21       0.5673      0.00000
     22       0.6358      0.00000
     23       1.5111      0.00000
     24       1.7309      0.00000
     25       2.0680      0.00000
     26       2.4479      0.00000
     27       2.5820      0.00000
     28       2.6347      0.00000

 k-point   331 :       0.0625   -0.1333    0.3333
  band No.  band energies     occupation 
      1     -25.5920      2.00000
      2     -22.0253      2.00000
      3     -20.5151      2.00000
      4     -20.0577      2.00000
      5     -17.0302      2.00000
      6     -16.2220      2.00000
      7     -14.3426      2.00000
      8     -13.2928      2.00000
      9     -12.8902      2.00000
     10     -12.3926      2.00000
     11     -10.9597      2.00000
     12     -10.5047      2.00000
     13      -9.8857      2.00000
     14      -9.2632      2.00000
     15      -8.7425      2.00000
     16      -7.6858      2.00000
     17      -5.1743      2.00000
     18      -4.1069      2.00000
     19      -3.8380      2.00000
     20      -3.2821      2.00000
     21       0.5906      0.00000
     22       0.6648      0.00000
     23       1.5473      0.00000
     24       1.7658      0.00000
     25       2.1015      0.00000
     26       2.4803      0.00000
     27       2.6528      0.00000
     28       2.6943      0.00000

 k-point   332 :       0.1250   -0.1333    0.3333
  band No.  band energies     occupation 
      1     -25.5118      2.00000
      2     -21.9587      2.00000
      3     -20.9243      2.00000
      4     -20.0550      2.00000
      5     -16.5456      2.00000
      6     -16.4714      2.00000
      7     -14.6606      2.00000
      8     -13.1105      2.00000
      9     -12.8055      2.00000
     10     -12.0740      2.00000
     11     -10.9464      2.00000
     12     -10.2433      2.00000
     13      -9.9349      2.00000
     14      -9.3873      2.00000
     15      -8.8444      2.00000
     16      -7.7886      2.00000
     17      -5.1422      2.00000
     18      -4.1855      2.00000
     19      -3.9654      2.00000
     20      -3.3582      2.00000
     21       0.6627      0.00000
     22       0.7526      0.00000
     23       1.6560      0.00000
     24       1.8708      0.00000
     25       2.2024      0.00000
     26       2.5753      0.00000
     27       2.8332      0.00000
     28       2.8673      0.00000

 k-point   333 :       0.1875   -0.1333    0.3333
  band No.  band energies     occupation 
      1     -25.3783      2.00000
      2     -21.8490      2.00000
      3     -21.4398      2.00000
      4     -20.0636      2.00000
      5     -16.7674      2.00000
      6     -15.9121      2.00000
      7     -15.0673      2.00000
      8     -12.8964      2.00000
      9     -12.6661      2.00000
     10     -11.6287      2.00000
     11     -10.9552      2.00000
     12     -10.0001      2.00000
     13      -9.9115      2.00000
     14      -9.5563      2.00000
     15      -8.9840      2.00000
     16      -7.9491      2.00000
     17      -5.0808      2.00000
     18      -4.3297      2.00000
     19      -4.1570      2.00000
     20      -3.4791      2.00000
     21       0.7896      0.00000
     22       0.9018      0.00000
     23       1.8374      0.00000
     24       2.0465      0.00000
     25       2.3719      0.00000
     26       2.7324      0.00000
     27       3.0434      0.00000
     28       3.1202      0.00000

 k-point   334 :       0.2500   -0.1333    0.3333
  band No.  band energies     occupation 
      1     -25.1922      2.00000
      2     -21.9840      2.00000
      3     -21.6985      2.00000
      4     -20.1031      2.00000
      5     -17.0267      2.00000
      6     -15.5018      2.00000
      7     -15.2195      2.00000
      8     -12.6654      2.00000
      9     -12.4785      2.00000
     10     -11.1553      2.00000
     11     -11.0319      2.00000
     12     -10.0412      2.00000
     13      -9.8447      2.00000
     14      -9.4662      2.00000
     15      -9.1445      2.00000
     16      -8.1473      2.00000
     17      -4.9860      2.00000
     18      -4.5347      2.00000
     19      -4.3881      2.00000
     20      -3.6346      2.00000
     21       0.9771      0.00000
     22       1.1165      0.00000
     23       2.0918      0.00000
     24       2.2936      0.00000
     25       2.6106      0.00000
     26       2.9529      0.00000
     27       3.1860      0.00000
     28       3.4057      0.00000

 k-point   335 :       0.3125   -0.1333    0.3333
  band No.  band energies     occupation 
      1     -24.9539      2.00000
      2     -22.5202      2.00000
      3     -21.5109      2.00000
      4     -20.1944      2.00000
      5     -17.1923      2.00000
      6     -15.9292      2.00000
      7     -14.5222      2.00000
      8     -12.4120      2.00000
      9     -12.2706      2.00000
     10     -11.1844      2.00000
     11     -10.8394      2.00000
     12     -10.0477      2.00000
     13      -9.9096      2.00000
     14      -9.3060      2.00000
     15      -9.1734      2.00000
     16      -8.3620      2.00000
     17      -4.8595      2.00000
     18      -4.7669      2.00000
     19      -4.6306      2.00000
     20      -3.8115      2.00000
     21       1.2278      0.00000
     22       1.4002      0.00000
     23       2.4190      0.00000
     24       2.6125      0.00000
     25       2.9084      0.00000
     26       3.1273      0.00000
     27       3.2665      0.00000
     28       3.6931      0.00000

 k-point   336 :       0.3750   -0.1333    0.3333
  band No.  band energies     occupation 
      1     -24.6645      2.00000
      2     -23.0305      2.00000
      3     -21.2919      2.00000
      4     -20.3485      2.00000
      5     -17.2340      2.00000
      6     -16.3263      2.00000
      7     -13.8592      2.00000
      8     -12.1605      2.00000
      9     -12.1323      2.00000
     10     -11.2808      2.00000
     11     -10.9080      2.00000
     12     -10.1299      2.00000
     13      -9.6704      2.00000
     14      -9.3766      2.00000
     15      -8.9766      2.00000
     16      -8.5856      2.00000
     17      -4.9721      2.00000
     18      -4.8532      2.00000
     19      -4.7084      2.00000
     20      -3.9966      2.00000
     21       1.5388      0.00000
     22       1.7527      0.00000
     23       2.8135      0.00000
     24       2.8988      0.00000
     25       3.0094      0.00000
     26       3.2981      0.00000
     27       3.4958      0.00000
     28       3.6138      0.00000

 k-point   337 :       0.4375   -0.1333    0.3333
  band No.  band energies     occupation 
      1     -24.3252      2.00000
      2     -23.5050      2.00000
      3     -21.0503      2.00000
      4     -20.5574      2.00000
      5     -17.1495      2.00000
      6     -16.6746      2.00000
      7     -13.2600      2.00000
      8     -12.3442      2.00000
      9     -11.8278      2.00000
     10     -11.1839      2.00000
     11     -11.1076      2.00000
     12     -10.3940      2.00000
     13      -9.3213      2.00000
     14      -9.2700      2.00000
     15      -8.9309      2.00000
     16      -8.8210      2.00000
     17      -5.0968      2.00000
     18      -5.0238      2.00000
     19      -4.5411      2.00000
     20      -4.1817      2.00000
     21       1.8987      0.00000
     22       2.1695      0.00000
     23       2.6356      0.00000
     24       3.1583      0.00000
     25       3.1946      0.00000
     26       3.3086      0.00000
     27       3.4688      0.00000
     28       3.5329      0.00000

 k-point   338 :       0.5000   -0.1333    0.3333
  band No.  band energies     occupation 
      1     -23.9383      2.00000
      2     -23.9374      2.00000
      3     -20.7996      2.00000
      4     -20.7987      2.00000
      5     -16.9569      2.00000
      6     -16.9546      2.00000
      7     -12.7464      2.00000
      8     -12.7441      2.00000
      9     -11.5066      2.00000
     10     -11.5052      2.00000
     11     -10.7595      2.00000
     12     -10.7583      2.00000
     13      -9.0613      2.00000
     14      -9.0598      2.00000
     15      -9.0528      2.00000
     16      -9.0514      2.00000
     17      -5.1150      2.00000
     18      -5.1106      2.00000
     19      -4.3653      2.00000
     20      -4.3627      2.00000
     21       2.2824      0.00000
     22       2.2829      0.00000
     23       2.6422      0.00000
     24       2.6439      0.00000
     25       3.2406      0.00000
     26       3.2413      0.00000
     27       3.8454      0.00000
     28       3.8454      0.00000

 k-point   339 :      -0.4375   -0.1333    0.3333
  band No.  band energies     occupation 
      1     -24.3252      2.00000
      2     -23.5050      2.00000
      3     -21.0503      2.00000
      4     -20.5573      2.00000
      5     -17.1500      2.00000
      6     -16.6741      2.00000
      7     -13.2604      2.00000
      8     -12.3434      2.00000
      9     -11.8280      2.00000
     10     -11.1837      2.00000
     11     -11.1079      2.00000
     12     -10.3943      2.00000
     13      -9.3225      2.00000
     14      -9.2704      2.00000
     15      -8.9297      2.00000
     16      -8.8205      2.00000
     17      -5.0965      2.00000
     18      -5.0241      2.00000
     19      -4.5403      2.00000
     20      -4.1825      2.00000
     21       1.8988      0.00000
     22       2.1696      0.00000
     23       2.6359      0.00000
     24       3.1581      0.00000
     25       3.1941      0.00000
     26       3.3087      0.00000
     27       3.4690      0.00000
     28       3.5331      0.00000

 k-point   340 :      -0.3750   -0.1333    0.3333
  band No.  band energies     occupation 
      1     -24.6645      2.00000
      2     -23.0305      2.00000
      3     -21.2919      2.00000
      4     -20.3484      2.00000
      5     -17.2345      2.00000
      6     -16.3257      2.00000
      7     -13.8594      2.00000
      8     -12.1597      2.00000
      9     -12.1325      2.00000
     10     -11.2811      2.00000
     11     -10.9077      2.00000
     12     -10.1307      2.00000
     13      -9.6717      2.00000
     14      -9.3766      2.00000
     15      -8.9756      2.00000
     16      -8.5850      2.00000
     17      -4.9718      2.00000
     18      -4.8535      2.00000
     19      -4.7076      2.00000
     20      -3.9973      2.00000
     21       1.5390      0.00000
     22       1.7527      0.00000
     23       2.8135      0.00000
     24       2.8993      0.00000
     25       3.0094      0.00000
     26       3.2979      0.00000
     27       3.4961      0.00000
     28       3.6130      0.00000

 k-point   341 :      -0.3125   -0.1333    0.3333
  band No.  band energies     occupation 
      1     -24.9539      2.00000
      2     -22.5202      2.00000
      3     -21.5109      2.00000
      4     -20.1943      2.00000
      5     -17.1928      2.00000
      6     -15.9286      2.00000
      7     -14.5223      2.00000
      8     -12.4122      2.00000
      9     -12.2701      2.00000
     10     -11.1842      2.00000
     11     -10.8395      2.00000
     12     -10.0490      2.00000
     13      -9.9107      2.00000
     14      -9.3057      2.00000
     15      -9.1725      2.00000
     16      -8.3615      2.00000
     17      -4.8587      2.00000
     18      -4.7667      2.00000
     19      -4.6310      2.00000
     20      -3.8121      2.00000
     21       1.2280      0.00000
     22       1.4003      0.00000
     23       2.4190      0.00000
     24       2.6126      0.00000
     25       2.9085      0.00000
     26       3.1280      0.00000
     27       3.2665      0.00000
     28       3.6926      0.00000

 k-point   342 :      -0.2500   -0.1333    0.3333
  band No.  band energies     occupation 
      1     -25.1922      2.00000
      2     -21.9840      2.00000
      3     -21.6985      2.00000
      4     -20.1030      2.00000
      5     -17.0272      2.00000
      6     -15.5011      2.00000
      7     -15.2196      2.00000
      8     -12.6656      2.00000
      9     -12.4783      2.00000
     10     -11.1559      2.00000
     11     -11.0313      2.00000
     12     -10.0426      2.00000
     13      -9.8451      2.00000
     14      -9.4656      2.00000
     15      -9.1443      2.00000
     16      -8.1468      2.00000
     17      -4.9852      2.00000
     18      -4.5344      2.00000
     19      -4.3885      2.00000
     20      -3.6351      2.00000
     21       0.9773      0.00000
     22       1.1166      0.00000
     23       2.0918      0.00000
     24       2.2937      0.00000
     25       2.6107      0.00000
     26       2.9532      0.00000
     27       3.1865      0.00000
     28       3.4057      0.00000

 k-point   343 :      -0.1875   -0.1333    0.3333
  band No.  band energies     occupation 
      1     -25.3783      2.00000
      2     -21.8490      2.00000
      3     -21.4398      2.00000
      4     -20.0636      2.00000
      5     -16.7679      2.00000
      6     -15.9121      2.00000
      7     -15.0664      2.00000
      8     -12.8965      2.00000
      9     -12.6660      2.00000
     10     -11.6297      2.00000
     11     -10.9546      2.00000
     12     -10.0012      2.00000
     13      -9.9106      2.00000
     14      -9.5567      2.00000
     15      -8.9839      2.00000
     16      -7.9487      2.00000
     17      -5.0801      2.00000
     18      -4.3294      2.00000
     19      -4.1574      2.00000
     20      -3.4795      2.00000
     21       0.7898      0.00000
     22       0.9018      0.00000
     23       1.8374      0.00000
     24       2.0465      0.00000
     25       2.3720      0.00000
     26       2.7326      0.00000
     27       3.0433      0.00000
     28       3.1202      0.00000

 k-point   344 :      -0.1250   -0.1333    0.3333
  band No.  band energies     occupation 
      1     -25.5118      2.00000
      2     -21.9587      2.00000
      3     -20.9244      2.00000
      4     -20.0549      2.00000
      5     -16.5456      2.00000
      6     -16.4717      2.00000
      7     -14.6597      2.00000
      8     -13.1105      2.00000
      9     -12.8054      2.00000
     10     -12.0752      2.00000
     11     -10.9460      2.00000
     12     -10.2426      2.00000
     13      -9.9356      2.00000
     14      -9.3877      2.00000
     15      -8.8444      2.00000
     16      -7.7884      2.00000
     17      -5.1417      2.00000
     18      -4.1852      2.00000
     19      -3.9658      2.00000
     20      -3.3585      2.00000
     21       0.6628      0.00000
     22       0.7526      0.00000
     23       1.6560      0.00000
     24       1.8709      0.00000
     25       2.2024      0.00000
     26       2.5754      0.00000
     27       2.8326      0.00000
     28       2.8674      0.00000

 k-point   345 :      -0.0625   -0.1333    0.3333
  band No.  band energies     occupation 
      1     -25.5920      2.00000
      2     -22.0253      2.00000
      3     -20.5151      2.00000
      4     -20.0577      2.00000
      5     -17.0302      2.00000
      6     -16.2222      2.00000
      7     -14.3419      2.00000
      8     -13.2928      2.00000
      9     -12.8902      2.00000
     10     -12.3935      2.00000
     11     -10.9596      2.00000
     12     -10.5042      2.00000
     13      -9.8860      2.00000
     14      -9.2634      2.00000
     15      -8.7425      2.00000
     16      -7.6856      2.00000
     17      -5.1740      2.00000
     18      -4.1067      2.00000
     19      -3.8382      2.00000
     20      -3.2822      2.00000
     21       0.5906      0.00000
     22       0.6648      0.00000
     23       1.5473      0.00000
     24       1.7658      0.00000
     25       2.1015      0.00000
     26       2.4803      0.00000
     27       2.6524      0.00000
     28       2.6943      0.00000

 k-point   346 :       0.0000   -0.0667    0.3333
  band No.  band energies     occupation 
      1     -25.6920      2.00000
      2     -21.6180      2.00000
      3     -20.4166      2.00000
      4     -20.4059      2.00000
      5     -17.2540      2.00000
      6     -15.7482      2.00000
      7     -14.6390      2.00000
      8     -13.4492      2.00000
      9     -12.7151      2.00000
     10     -12.3273      2.00000
     11     -11.0079      2.00000
     12     -10.8993      2.00000
     13      -9.9042      2.00000
     14      -9.2901      2.00000
     15      -8.5400      2.00000
     16      -7.6818      2.00000
     17      -5.1238      2.00000
     18      -4.0548      2.00000
     19      -3.7400      2.00000
     20      -3.1895      2.00000
     21       0.5026      0.00000
     22       0.5759      0.00000
     23       1.4052      0.00000
     24       1.6339      0.00000
     25       1.9743      0.00000
     26       2.4118      0.00000
     27       2.5157      0.00000
     28       2.6126      0.00000

 k-point   347 :       0.0625   -0.0667    0.3333
  band No.  band energies     occupation 
      1     -25.6652      2.00000
      2     -21.5971      2.00000
      3     -20.5737      2.00000
      4     -20.4062      2.00000
      5     -17.0580      2.00000
      6     -15.8598      2.00000
      7     -14.7671      2.00000
      8     -13.3811      2.00000
      9     -12.6911      2.00000
     10     -12.1948      2.00000
     11     -10.9896      2.00000
     12     -10.7973      2.00000
     13      -9.9217      2.00000
     14      -9.3370      2.00000
     15      -8.5884      2.00000
     16      -7.7206      2.00000
     17      -5.1108      2.00000
     18      -4.0793      2.00000
     19      -3.7863      2.00000
     20      -3.2139      2.00000
     21       0.5253      0.00000
     22       0.6056      0.00000
     23       1.4414      0.00000
     24       1.6691      0.00000
     25       2.0079      0.00000
     26       2.4462      0.00000
     27       2.5883      0.00000
     28       2.6827      0.00000

 k-point   348 :       0.1250   -0.0667    0.3333
  band No.  band energies     occupation 
      1     -25.5848      2.00000
      2     -21.5351      2.00000
      3     -20.9850      2.00000
      4     -20.3777      2.00000
      5     -16.5635      2.00000
      6     -16.1398      2.00000
      7     -15.0824      2.00000
      8     -13.2241      2.00000
      9     -12.6200      2.00000
     10     -11.8503      2.00000
     11     -10.9379      2.00000
     12     -10.5227      2.00000
     13      -9.9774      2.00000
     14      -9.4701      2.00000
     15      -8.7233      2.00000
     16      -7.8293      2.00000
     17      -5.0693      2.00000
     18      -4.1601      2.00000
     19      -3.9179      2.00000
     20      -3.2856      2.00000
     21       0.5959      0.00000
     22       0.6957      0.00000
     23       1.5500      0.00000
     24       1.7750      0.00000
     25       2.1094      0.00000
     26       2.5452      0.00000
     27       2.7972      0.00000
     28       2.8520      0.00000

 k-point   349 :       0.1875   -0.0667    0.3333
  band No.  band energies     occupation 
      1     -25.4512      2.00000
      2     -21.5028      2.00000
      3     -21.4338      2.00000
      4     -20.3386      2.00000
      5     -16.4882      2.00000
      6     -15.9133      2.00000
      7     -15.4835      2.00000
      8     -13.0294      2.00000
      9     -12.5049      2.00000
     10     -11.3983      2.00000
     11     -10.8665      2.00000
     12     -10.1505      2.00000
     13     -10.0747      2.00000
     14      -9.6594      2.00000
     15      -8.9188      2.00000
     16      -7.9879      2.00000
     17      -4.9954      2.00000
     18      -4.3090      2.00000
     19      -4.1157      2.00000
     20      -3.4002      2.00000
     21       0.7205      0.00000
     22       0.8493      0.00000
     23       1.7315      0.00000
     24       1.9521      0.00000
     25       2.2801      0.00000
     26       2.7083      0.00000
     27       3.0207      0.00000
     28       3.1177      0.00000

 k-point   350 :       0.2500   -0.0667    0.3333
  band No.  band energies     occupation 
      1     -25.2648      2.00000
      2     -22.0490      2.00000
      3     -21.2967      2.00000
      4     -20.3024      2.00000
      5     -16.8265      2.00000
      6     -15.9071      2.00000
      7     -15.1955      2.00000
      8     -12.8081      2.00000
      9     -12.3538      2.00000
     10     -10.9661      2.00000
     11     -10.8155      2.00000
     12     -10.1953      2.00000
     13      -9.8995      2.00000
     14      -9.6923      2.00000
     15      -9.1422      2.00000
     16      -8.1735      2.00000
     17      -4.8873      2.00000
     18      -4.5204      2.00000
     19      -4.3532      2.00000
     20      -3.5488      2.00000
     21       0.9052      0.00000
     22       1.0705      0.00000
     23       1.9859      0.00000
     24       2.2013      0.00000
     25       2.5208      0.00000
     26       2.9369      0.00000
     27       3.1792      0.00000
     28       3.4516      0.00000

 k-point   351 :       0.3125   -0.0667    0.3333
  band No.  band energies     occupation 
      1     -25.0261      2.00000
      2     -22.5869      2.00000
      3     -21.1296      2.00000
      4     -20.2894      2.00000
      5     -17.0991      2.00000
      6     -16.3157      2.00000
      7     -14.4618      2.00000
      8     -12.5577      2.00000
      9     -12.1883      2.00000
     10     -10.8647      2.00000
     11     -10.7957      2.00000
     12     -10.2845      2.00000
     13      -9.8497      2.00000
     14      -9.3521      2.00000
     15      -9.3439      2.00000
     16      -8.3739      2.00000
     17      -4.7589      2.00000
     18      -4.7488      2.00000
     19      -4.6011      2.00000
     20      -3.7186      2.00000
     21       1.1535      0.00000
     22       1.3619      0.00000
     23       2.3133      0.00000
     24       2.5230      0.00000
     25       2.8274      0.00000
     26       3.1809      0.00000
     27       3.2868      0.00000
     28       3.5447      0.00000

 k-point   352 :       0.3750   -0.0667    0.3333
  band No.  band energies     occupation 
      1     -24.7361      2.00000
      2     -23.0986      2.00000
      3     -20.9413      2.00000
      4     -20.3219      2.00000
      5     -17.2642      2.00000
      6     -16.6829      2.00000
      7     -13.7508      2.00000
      8     -12.2767      2.00000
      9     -12.0758      2.00000
     10     -11.0001      2.00000
     11     -10.9843      2.00000
     12     -10.3786      2.00000
     13      -9.5437      2.00000
     14      -9.4268      2.00000
     15      -9.0873      2.00000
     16      -8.5940      2.00000
     17      -4.9665      2.00000
     18      -4.8289      2.00000
     19      -4.5891      2.00000
     20      -3.8962      2.00000
     21       1.4631      0.00000
     22       1.7226      0.00000
     23       2.7122      0.00000
     24       2.9093      0.00000
     25       2.9740      0.00000
     26       3.1900      0.00000
     27       3.3723      0.00000
     28       3.6350      0.00000

 k-point   353 :       0.4375   -0.0667    0.3333
  band No.  band energies     occupation 
      1     -24.3962      2.00000
      2     -23.5743      2.00000
      3     -20.7456      2.00000
      4     -20.4142      2.00000
      5     -17.2976      2.00000
      6     -16.9854      2.00000
      7     -13.0994      2.00000
      8     -12.1748      2.00000
      9     -11.9675      2.00000
     10     -11.2987      2.00000
     11     -11.0183      2.00000
     12     -10.5818      2.00000
     13      -9.3219      2.00000
     14      -9.2224      2.00000
     15      -8.9664      2.00000
     16      -8.8405      2.00000
     17      -5.0892      2.00000
     18      -5.0053      2.00000
     19      -4.4190      2.00000
     20      -4.0726      2.00000
     21       1.8234      0.00000
     22       2.1490      0.00000
     23       2.6048      0.00000
     24       3.1146      0.00000
     25       3.1688      0.00000
     26       3.2132      0.00000
     27       3.3932      0.00000
     28       3.4359      0.00000

 k-point   354 :       0.5000   -0.0667    0.3333
  band No.  band energies     occupation 
      1     -24.0086      2.00000
      2     -24.0076      2.00000
      3     -20.5628      2.00000
      4     -20.5614      2.00000
      5     -17.2001      2.00000
      6     -17.1972      2.00000
      7     -12.5515      2.00000
      8     -12.5489      2.00000
      9     -11.6377      2.00000
     10     -11.6362      2.00000
     11     -10.8374      2.00000
     12     -10.8362      2.00000
     13      -9.0995      2.00000
     14      -9.0980      2.00000
     15      -9.0148      2.00000
     16      -9.0134      2.00000
     17      -5.1026      2.00000
     18      -5.0979      2.00000
     19      -4.2476      2.00000
     20      -4.2448      2.00000
     21       2.2127      0.00000
     22       2.2131      0.00000
     23       2.6337      0.00000
     24       2.6354      0.00000
     25       3.1741      0.00000
     26       3.1746      0.00000
     27       3.7417      0.00000
     28       3.7417      0.00000

 k-point   355 :      -0.4375   -0.0667    0.3333
  band No.  band energies     occupation 
      1     -24.3962      2.00000
      2     -23.5743      2.00000
      3     -20.7457      2.00000
      4     -20.4142      2.00000
      5     -17.2981      2.00000
      6     -16.9850      2.00000
      7     -13.0996      2.00000
      8     -12.1742      2.00000
      9     -11.9676      2.00000
     10     -11.2986      2.00000
     11     -11.0187      2.00000
     12     -10.5819      2.00000
     13      -9.3221      2.00000
     14      -9.2233      2.00000
     15      -8.9655      2.00000
     16      -8.8402      2.00000
     17      -5.0891      2.00000
     18      -5.0055      2.00000
     19      -4.4186      2.00000
     20      -4.0730      2.00000
     21       1.8235      0.00000
     22       2.1490      0.00000
     23       2.6050      0.00000
     24       3.1143      0.00000
     25       3.1687      0.00000
     26       3.2132      0.00000
     27       3.3931      0.00000
     28       3.4361      0.00000

 k-point   356 :      -0.3750   -0.0667    0.3333
  band No.  band energies     occupation 
      1     -24.7361      2.00000
      2     -23.0986      2.00000
      3     -20.9413      2.00000
      4     -20.3219      2.00000
      5     -17.2647      2.00000
      6     -16.6824      2.00000
      7     -13.7510      2.00000
      8     -12.2768      2.00000
      9     -12.0753      2.00000
     10     -11.0002      2.00000
     11     -10.9841      2.00000
     12     -10.3791      2.00000
     13      -9.5447      2.00000
     14      -9.4268      2.00000
     15      -9.0865      2.00000
     16      -8.5937      2.00000
     17      -4.9663      2.00000
     18      -4.8291      2.00000
     19      -4.5886      2.00000
     20      -3.8966      2.00000
     21       1.4632      0.00000
     22       1.7227      0.00000
     23       2.7122      0.00000
     24       2.9095      0.00000
     25       2.9743      0.00000
     26       3.1897      0.00000
     27       3.3721      0.00000
     28       3.6346      0.00000

 k-point   357 :      -0.3125   -0.0667    0.3333
  band No.  band energies     occupation 
      1     -25.0261      2.00000
      2     -22.5869      2.00000
      3     -21.1296      2.00000
      4     -20.2893      2.00000
      5     -17.0995      2.00000
      6     -16.3152      2.00000
      7     -14.4619      2.00000
      8     -12.5578      2.00000
      9     -12.1880      2.00000
     10     -10.8643      2.00000
     11     -10.7956      2.00000
     12     -10.2854      2.00000
     13      -9.8508      2.00000
     14      -9.3512      2.00000
     15      -9.3439      2.00000
     16      -8.3736      2.00000
     17      -4.7586      2.00000
     18      -4.7484      2.00000
     19      -4.6014      2.00000
     20      -3.7189      2.00000
     21       1.1536      0.00000
     22       1.3619      0.00000
     23       2.3133      0.00000
     24       2.5230      0.00000
     25       2.8274      0.00000
     26       3.1816      0.00000
     27       3.2869      0.00000
     28       3.5437      0.00000

 k-point   358 :      -0.2500   -0.0667    0.3333
  band No.  band energies     occupation 
      1     -25.2647      2.00000
      2     -22.0490      2.00000
      3     -21.2967      2.00000
      4     -20.3024      2.00000
      5     -16.8270      2.00000
      6     -15.9065      2.00000
      7     -15.1956      2.00000
      8     -12.8082      2.00000
      9     -12.3537      2.00000
     10     -10.9664      2.00000
     11     -10.8150      2.00000
     12     -10.1962      2.00000
     13      -9.9002      2.00000
     14      -9.6915      2.00000
     15      -9.1422      2.00000
     16      -8.1732      2.00000
     17      -4.8869      2.00000
     18      -4.5202      2.00000
     19      -4.3535      2.00000
     20      -3.5491      2.00000
     21       0.9053      0.00000
     22       1.0705      0.00000
     23       1.9859      0.00000
     24       2.2014      0.00000
     25       2.5208      0.00000
     26       2.9371      0.00000
     27       3.1795      0.00000
     28       3.4516      0.00000

 k-point   359 :      -0.1875   -0.0667    0.3333
  band No.  band energies     occupation 
      1     -25.4512      2.00000
      2     -21.5028      2.00000
      3     -21.4338      2.00000
      4     -20.3385      2.00000
      5     -16.4886      2.00000
      6     -15.9133      2.00000
      7     -15.4829      2.00000
      8     -13.0295      2.00000
      9     -12.5048      2.00000
     10     -11.3988      2.00000
     11     -10.8662      2.00000
     12     -10.1499      2.00000
     13     -10.0752      2.00000
     14      -9.6596      2.00000
     15      -8.9189      2.00000
     16      -7.9877      2.00000
     17      -4.9950      2.00000
     18      -4.3088      2.00000
     19      -4.1159      2.00000
     20      -3.4004      2.00000
     21       0.7205      0.00000
     22       0.8494      0.00000
     23       1.7314      0.00000
     24       1.9521      0.00000
     25       2.2801      0.00000
     26       2.7084      0.00000
     27       3.0206      0.00000
     28       3.1177      0.00000

 k-point   360 :      -0.1250   -0.0667    0.3333
  band No.  band energies     occupation 
      1     -25.5848      2.00000
      2     -21.5351      2.00000
      3     -20.9850      2.00000
      4     -20.3777      2.00000
      5     -16.5635      2.00000
      6     -16.1402      2.00000
      7     -15.0817      2.00000
      8     -13.2242      2.00000
      9     -12.6199      2.00000
     10     -11.8509      2.00000
     11     -10.9377      2.00000
     12     -10.5222      2.00000
     13      -9.9777      2.00000
     14      -9.4703      2.00000
     15      -8.7234      2.00000
     16      -7.8291      2.00000
     17      -5.0691      2.00000
     18      -4.1599      2.00000
     19      -3.9181      2.00000
     20      -3.2858      2.00000
     21       0.5959      0.00000
     22       0.6957      0.00000
     23       1.5500      0.00000
     24       1.7750      0.00000
     25       2.1094      0.00000
     26       2.5452      0.00000
     27       2.7969      0.00000
     28       2.8519      0.00000

 k-point   361 :      -0.0625   -0.0667    0.3333
  band No.  band energies     occupation 
      1     -25.6652      2.00000
      2     -21.5971      2.00000
      3     -20.5737      2.00000
      4     -20.4062      2.00000
      5     -17.0580      2.00000
      6     -15.8601      2.00000
      7     -14.7666      2.00000
      8     -13.3812      2.00000
      9     -12.6911      2.00000
     10     -12.1952      2.00000
     11     -10.9895      2.00000
     12     -10.7970      2.00000
     13      -9.9218      2.00000
     14      -9.3371      2.00000
     15      -8.5885      2.00000
     16      -7.7205      2.00000
     17      -5.1106      2.00000
     18      -4.0792      2.00000
     19      -3.7864      2.00000
     20      -3.2139      2.00000
     21       0.5253      0.00000
     22       0.6056      0.00000
     23       1.4414      0.00000
     24       1.6691      0.00000
     25       2.0079      0.00000
     26       2.4463      0.00000
     27       2.5882      0.00000
     28       2.6825      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
 10.300  13.699  -0.003   0.005  -0.002   0.008  -0.015   0.006
 13.699  18.220  -0.003   0.006  -0.002   0.010  -0.020   0.007
 -0.003  -0.003  -4.438  -0.003   0.001   8.693   0.006  -0.003
  0.005   0.006  -0.003  -4.433  -0.002   0.006   8.682   0.004
 -0.002  -0.002   0.001  -0.002  -4.439  -0.003   0.004   8.695
  0.008   0.010   8.693   0.006  -0.003 -19.169  -0.013   0.005
 -0.015  -0.020   0.006   8.682   0.004  -0.013 -19.147  -0.008
  0.006   0.007  -0.003   0.004   8.695   0.005  -0.008 -19.173
 total augmentation occupancy for first ion, spin component:           1
  7.224  -3.190  -0.097   0.074  -0.009  -0.026   0.030  -0.007
 -3.190   1.508   0.095  -0.116   0.034   0.018  -0.023   0.006
 -0.097   0.095   1.504  -0.067   0.009   0.135   0.003  -0.003
  0.074  -0.116  -0.067   1.576  -0.049   0.003   0.127   0.002
 -0.009   0.034   0.009  -0.049   1.473  -0.003   0.002   0.135
 -0.026   0.018   0.135   0.003  -0.003   0.014   0.001  -0.001
  0.030  -0.023   0.003   0.127   0.002   0.001   0.012   0.001
 -0.007   0.006  -0.003   0.002   0.135  -0.001   0.001   0.014


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


    CHARGE:  cpu time    1.1345: real time    1.1375
    FORLOC:  cpu time    0.0157: real time    0.0157
    FORNL :  cpu time    1.8389: real time    1.8520
    STRESS:  cpu time    9.2033: real time    9.2281
    FORCOR:  cpu time    0.1279: real time    0.1282
    FORHAR:  cpu time    0.0393: real time    0.0394
    MIXING:  cpu time    0.0099: real time    0.0099
    OFIELD:  cpu time    0.0001: real time    0.0002

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

         DFTD3 V3.0 Rev 1        
 IVDW         = 12
 DF pbe       
 parameters
 VDW_S6       =    1.0000
 VDW_S8       =    0.7875
 VDW_A1       =    0.4289
 VDW_A2       =    4.4407
 k1-k3        =   16.0000    1.3333   -4.0000
 VDW_RADIUS   =   50.2022 A
 VDW_CNRADIUS =   21.1671 A
 Edisp (eV)   -0.90105

 E6    (eV) :    -0.6525
 E8    (eV) :    -0.2485
 % E8        : 27.58
    FORVDW:  cpu time    0.0379: real time    0.0397

  FORCE on cell =-STRESS in cart. coord.  units (eV):
  Direction    XX          YY          ZZ          XY          YZ          ZX
  --------------------------------------------------------------------------------------
  Alpha Z    13.77444    13.77444    13.77444
  Ewald   17107.69514 16946.03860-18207.06979     0.05282     0.00134     0.05513
  Hartree 17151.10875 17062.16680-16929.43574     0.01168     0.00460     0.00315
  E(xc)    -159.06731  -159.45750  -160.64153     0.00029    -0.00008     0.00078
  Local  -34708.08104-34466.66434 34638.02905    -0.05337    -0.00810    -0.04832
  n-local   -72.80719   -76.10573   -84.34877    -0.00017    -0.00015     0.00244
  augment     2.67491     3.06823     4.41072    -0.00024     0.00003    -0.00043
  Kinetic   664.16582   676.79477   723.36801    -0.00706     0.00748    -0.05043
  Fock        0.00000     0.00000     0.00000     0.00000     0.00000     0.00000
  vdW        -0.91673    -0.93447    -0.21497     0.00000     0.00001    -0.00000
  -------------------------------------------------------------------------------------
  Total      -1.45323    -1.31920    -2.12859     0.00396     0.00513    -0.03768
  in kB      -4.50218    -4.08696    -6.59450     0.01226     0.01590    -0.11674
  external pressure =       -5.06 kB  Pullay stress =        0.00 kB


 VOLUME and BASIS-vectors are now :
 -----------------------------------------------------------------------------
  energy-cutoff  :      800.00
  volume of cell :      517.16
      direct lattice vectors                 reciprocal lattice vectors
     4.001094818  0.000000000  0.000000000     0.249931593  0.000000000  0.000000000
     0.000000000  4.308450695  0.000000000     0.000000000  0.232101995  0.000000000
     0.000000000  0.000000000 30.000000000     0.000000000  0.000000000  0.033333333

  length of vectors
     4.001094818  4.308450695 30.000000000     0.249931593  0.232101995  0.033333333


 FORCES acting on ions
    electron-ion (+dipol)            ewald-force                    non-local-force                 convergence-correction
 -----------------------------------------------------------------------------------------------
   -.732E+01 -.341E+02 0.301E+03   0.919E+01 0.367E+02 -.306E+03   -.176E+01 -.249E+01 0.466E+01   -.368E-06 0.224E-06 0.412E-06
   -.727E+01 0.341E+02 -.302E+03   0.914E+01 -.367E+02 0.307E+03   -.176E+01 0.248E+01 -.466E+01   -.147E-06 -.241E-06 -.392E-06
   -.731E+01 -.341E+02 -.302E+03   0.918E+01 0.367E+02 0.307E+03   -.176E+01 -.248E+01 -.466E+01   0.142E-07 -.248E-06 -.230E-06
   -.732E+01 0.342E+02 0.302E+03   0.919E+01 -.368E+02 -.307E+03   -.176E+01 0.248E+01 0.467E+01   0.219E-06 0.311E-06 0.154E-06
   -.100E+02 -.210E+02 0.179E+03   0.114E+02 0.229E+02 -.184E+03   -.150E+01 -.215E+01 0.489E+01   0.484E-07 0.128E-06 -.202E-06
   -.100E+02 0.209E+02 -.179E+03   0.114E+02 -.229E+02 0.184E+03   -.150E+01 0.214E+01 -.488E+01   0.897E-07 -.144E-06 0.245E-06
   -.100E+02 -.209E+02 -.179E+03   0.114E+02 0.229E+02 0.184E+03   -.150E+01 -.215E+01 -.488E+01   0.258E-07 0.651E-07 0.873E-07
   -.999E+01 0.209E+02 0.179E+03   0.114E+02 -.229E+02 -.184E+03   -.149E+01 0.214E+01 0.489E+01   0.810E-07 -.987E-07 -.194E-06
   0.128E+02 -.390E+02 0.330E+03   -.206E+02 0.499E+02 -.348E+03   0.774E+01 -.110E+02 0.175E+02   -.709E-07 0.110E-06 -.380E-06
   0.128E+02 0.390E+02 -.331E+03   -.205E+02 -.500E+02 0.348E+03   0.774E+01 0.110E+02 -.176E+02   -.724E-06 0.684E-07 0.253E-06
   0.128E+02 -.390E+02 -.330E+03   -.206E+02 0.500E+02 0.347E+03   0.774E+01 -.110E+02 -.175E+02   0.341E-06 0.585E-06 0.165E-06
   0.128E+02 0.390E+02 0.330E+03   -.206E+02 -.500E+02 -.348E+03   0.774E+01 0.110E+02 0.176E+02   -.489E-06 -.565E-06 0.791E-07
 -----------------------------------------------------------------------------------------------
   -.179E+02 0.184E-01 -.281E-01   0.711E-14 -.142E-13 0.568E-13   0.179E+02 -.184E-01 0.280E-01   -.980E-06 0.195E-06 -.152E-08
 
 
 POSITION                                       TOTAL-FORCE (eV/Angst)
 -----------------------------------------------------------------------------------
      2.30618      3.87654     29.52391         0.105913      0.098130     -0.318247
      0.30600      0.32863      0.72962         0.104068     -0.098996      0.323808
      2.30637      1.72224      0.72934         0.107279      0.103185      0.321953
      0.30556      2.48293     29.52288         0.105137     -0.100103     -0.314795
      2.61130      4.30467     28.53534        -0.119047     -0.168472      0.378139
      0.61257      4.21063      1.71905        -0.128804      0.166843     -0.391066
      2.61224      2.14992      1.71825        -0.127357     -0.167941     -0.385193
      0.60995      2.05639     28.53308        -0.117069      0.165496      0.388554
      0.83485      3.83389     29.60436         0.020836     -0.027056      0.157701
      2.83576      0.37109      0.64941         0.012099      0.027935     -0.161798
      0.83513      1.67963      0.64805         0.017135     -0.028331     -0.157341
      2.83535      2.52539     29.60394         0.019811      0.029310      0.158285
 -----------------------------------------------------------------------------------
    total drift:                                0.000180      0.000001     -0.000073


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



  FREE ENERGIE OF THE ION-ELECTRON SYSTEM (eV)
  ---------------------------------------------------
  free  energy   TOTEN  =       -82.95528267 eV

  energy  without entropy=      -82.95528267  energy(sigma->0) =      -82.95528267
  enthalpy is  TOTEN    =       -82.95495989 eV   P V=        0.00032278



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


    POTLOK:  cpu time    0.1177: real time    0.1180


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


     LOOP+:  cpu time  744.5587: real time  747.8392
    4ORBIT:  cpu time    0.0000: real time    0.0000

 total amount of memory used by VASP MPI-rank0   561509. kBytes
=======================================================================

   base      :      30000. kBytes
   nonl-proj :     233116. kBytes
   fftplans  :       9259. kBytes
   grid      :      16617. kBytes
   one-center:          6. kBytes
   wavefun   :     272511. kBytes
 
  
  
 General timing and accounting informations for this job:
 ========================================================
  
                  Total CPU time used (sec):      762.624
                            User time (sec):      757.616
                          System time (sec):        5.008
                         Elapsed time (sec):      765.997
  
                   Maximum memory used (kb):      642096.
                   Average memory used (kb):           0.
  
                          Minor page faults:       182123
                          Major page faults:            0
                 Voluntary context switches:         1426
