 vasp.5.4.4.18Apr17-6-g9f103f2a35 (build Feb 26 2024 21:44:19) complex          
  
 executed on             LinuxIFC date 2025.07.11  14:59:03
 running on   32 total cores
 distrk:  each k-point on    8 cores,    4 groups
 distr:  one band on NCORES_PER_BAND=   1 cores,    8 groups


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


 INCAR:
 POTCAR:    PAW_PBE Sn_d 06Sep2000                
 POTCAR:    PAW_PBE Se 06Sep2000                  
 POTCAR:    PAW_PBE N 08Apr2002                   
 POTCAR:    PAW_PBE Sr_sv 07Sep2000               

 ----------------------------------------------------------------------------- 
|                                                                             |
|           W    W    AA    RRRRR   N    N  II  N    N   GGGG   !!!           |
|           W    W   A  A   R    R  NN   N  II  NN   N  G    G  !!!           |
|           W    W  A    A  R    R  N N  N  II  N N  N  G       !!!           |
|           W WW W  AAAAAA  RRRRR   N  N N  II  N  N N  G  GGG   !            |
|           WW  WW  A    A  R   R   N   NN  II  N   NN  G    G                |
|           W    W  A    A  R    R  N    N  II  N    N   GGGG   !!!           |
|                                                                             |
|      For optimal performance we recommend to set                            |
|        NCORE= 4 - approx SQRT( number of cores)                             |
|      NCORE specifies how many cores store one orbital (NPAR=cpu/NCORE).     |
|      This setting can  greatly improve the performance of VASP for DFT.     |
|      The default,   NCORE=1            might be grossly inefficient         |
|      on modern multi-core architectures or massively parallel machines.     |
|      Do your own testing !!!!                                               |
|      Unfortunately you need to use the default for GW and RPA calculations. |
|      (for HF NCORE is supported but not extensively tested yet)             |
|                                                                             |
 ----------------------------------------------------------------------------- 


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

 POTCAR:    PAW_PBE Sn_d 06Sep2000                
   VRHFIN =Sn: s2p2                                                             
   LEXCH  = PE                                                                  
   EATOM  =  1893.1092 eV,  139.1396 Ry                                         
                                                                                
   TITEL  = PAW_PBE Sn_d 06Sep2000                                              
   LULTRA =        F    use ultrasoft PP ?                                      
   IUNSCR =        1    unscreen: 0-lin 1-nonlin 2-no                           
   RPACOR =    2.300    partial core radius                                     
   POMASS =  118.710; ZVAL   =   14.000    mass and valenz                      
   RCORE  =    2.500    outmost cutoff radius                                   
   RWIGS  =    2.960; RWIGS  =    1.566    wigner-seitz radius (au A)           
   ENMAX  =  241.083; ENMIN  =  180.812 eV                                      
   ICORE  =        3    local potential                                         
   LCOR   =        T    correct aug charges                                     
   LPAW   =        T    paw PP                                                  
   EAUG   =  439.825                                                            
   DEXC   =    0.000                                                            
   RMAX   =    2.560    core radius for proj-oper                               
   RAUG   =    1.300    factor for augmentation sphere                          
   RDEP   =    2.659    radius for radial grids                                 
   RDEPT  =    2.046    core radius for aug-charge                              
                                                                                
   Atomic configuration                                                         
   12 entries                                                                   
     n  l   j            E        occ.                                          
     1  0  0.50    -29007.2859   2.0000                                         
     2  0  0.50     -4378.8056   2.0000                                         
     2  1  1.50     -3930.4293   6.0000                                         
     3  0  0.50      -845.0264   2.0000                                         
     3  1  1.50      -698.5725   6.0000                                         
     3  2  2.50      -473.2839  10.0000                                         
     4  0  0.50      -133.9036   2.0000                                         
     4  1  1.50       -89.6752   6.0000                                         
     4  2  2.50       -25.8375  10.0000                                         
     5  0  0.50       -10.5484   2.0000                                         
     5  1  0.50        -3.6940   2.0000                                         
     4  3  2.50        -2.7416   0.0000                                         
   Description                                                                  
     l       E           TYP  RCUT    TYP  RCUT                                 
     2    -25.8374624     23  2.500                                             
     2     -5.4423304     23  2.500                                             
     0    -10.5483727     23  2.500                                             
     0     13.6058260     23  2.500                                             
     1     -3.6939829     23  2.500                                             
     1      1.9821976     23  2.500                                             
     3     -1.3605826      7  2.500                                             
  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=           2  read in
    real space projection operators read in
  non local Contribution for L=           2  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=           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  =           6
   number of lm-projection operators is LMMAX =          18
 
 POTCAR:    PAW_PBE Se 06Sep2000                  
   VRHFIN =Se: s2p4                                                             
   LEXCH  = PE                                                                  
   EATOM  =   257.1286 eV,   18.8984 Ry                                         
                                                                                
   TITEL  = PAW_PBE Se 06Sep2000                                                
   LULTRA =        F    use ultrasoft PP ?                                      
   IUNSCR =        1    unscreen: 0-lin 1-nonlin 2-no                           
   RPACOR =    1.900    partial core radius                                     
   POMASS =   78.960; ZVAL   =    6.000    mass and valenz                      
   RCORE  =    2.100    outmost cutoff radius                                   
   RWIGS  =    2.200; RWIGS  =    1.164    wigner-seitz radius (au A)           
   ENMAX  =  211.555; ENMIN  =  158.666 eV                                      
   ICORE  =        3    local potential                                         
   LCOR   =        T    correct aug charges                                     
   LPAW   =        T    paw PP                                                  
   EAUG   =  446.842                                                            
   DEXC   =    0.000                                                            
   RMAX   =    2.147    core radius for proj-oper                               
   RAUG   =    1.300    factor for augmentation sphere                          
   RDEP   =    2.177    radius for radial grids                                 
   RDEPT  =    1.928    core radius for aug-charge                              
                                                                                
   Atomic configuration                                                         
   10 entries                                                                   
     n  l   j            E        occ.                                          
     1  0  0.50    -12503.4787   2.0000                                         
     2  0  0.50     -1606.9547   2.0000                                         
     2  1  1.50     -1413.3140   6.0000                                         
     3  0  0.50      -213.4885   2.0000                                         
     3  1  1.50      -152.9538   6.0000                                         
     3  2  2.50       -53.1221  10.0000                                         
     4  0  0.50       -17.2865   2.0000                                         
     4  1  0.50        -6.5110   4.0000                                         
     4  2  2.50        -6.8029   0.0000                                         
     4  3  2.50        -6.8029   0.0000                                         
   Description                                                                  
     l       E           TYP  RCUT    TYP  RCUT                                 
     0    -17.2865377     23  2.100                                             
     0    -15.3094411     23  2.100                                             
     1     -6.5110275     23  2.100                                             
     1     -0.0695192     23  2.100                                             
     2     -6.8029130     23  2.100                                             
     3     -1.3605826      7  2.100                                             
  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
  non local Contribution for L=           2  read in
    real space projection operators read in
    PAW grid and wavefunctions read in
 
   number of l-projection  operators is LMAX  =           5
   number of lm-projection operators is LMMAX =          13
 
 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
 
 POTCAR:    PAW_PBE Sr_sv 07Sep2000               
   VRHFIN =Sr: 4s4p5s                                                           
   LEXCH  = PE                                                                  
   EATOM  =   843.0319 eV,   61.9611 Ry                                         
                                                                                
   TITEL  = PAW_PBE Sr_sv 07Sep2000                                             
   LULTRA =        F    use ultrasoft PP ?                                      
   IUNSCR =        1    unscreen: 0-lin 1-nonlin 2-no                           
   RPACOR =    2.200    partial core radius                                     
   POMASS =   87.620; ZVAL   =   10.000    mass and valenz                      
   RCORE  =    2.500    outmost cutoff radius                                   
   RWIGS  =    4.040; RWIGS  =    2.138    wigner-seitz radius (au A)           
   ENMAX  =  229.353; ENMIN  =  172.014 eV                                      
   RCLOC  =    2.201    cutoff for local pot                                    
   LCOR   =        T    correct aug charges                                     
   LPAW   =        T    paw PP                                                  
   EAUG   =  366.804                                                            
   DEXC   =    0.000                                                            
   RMAX   =    2.547    core radius for proj-oper                               
   RAUG   =    1.300    factor for augmentation sphere                          
   RDEP   =    2.562    radius for radial grids                                 
   RDEPT  =    2.128    core radius for aug-charge                              
                                                                                
   Atomic configuration                                                         
   10 entries                                                                   
     n  l   j            E        occ.                                          
     1  0  0.50    -15934.8930   2.0000                                         
     2  0  0.50     -2157.6250   2.0000                                         
     2  1  1.50     -1917.0034   6.0000                                         
     3  0  0.50      -333.7288   2.0000                                         
     3  1  1.50      -256.0992   6.0000                                         
     3  2  2.50      -127.9971  10.0000                                         
     4  0  0.50       -40.8953   2.0000                                         
     5  0  0.50        -3.5257   1.9990                                         
     4  1  1.50       -22.8179   6.0000                                         
     4  2  1.50        -1.2815   0.0010                                         
   Description                                                                  
     l       E           TYP  RCUT    TYP  RCUT                                 
     0    -40.8953213     23  2.480                                             
     0     -3.5257161     23  2.480                                             
     1    -22.8178632     23  2.500                                             
     1    -24.1784458     23  2.500                                             
     2     -1.2814598     23  2.500                                             
     2      0.2279365     23  2.500                                             
  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
  non local Contribution for L=           2  read in
    real space projection operators read in
  non local Contribution for L=           2  read in
    real space projection operators read in
    PAW grid and wavefunctions read in
 
   number of l-projection  operators is LMAX  =           6
   number of lm-projection operators is LMMAX =          18
 
  PAW_PBE Sn_d 06Sep2000                :
 energy of atom  1       EATOM=-1893.1092
 kinetic energy error for atom=    0.0026 (will be added to EATOM!!)
  PAW_PBE Se 06Sep2000                  :
 energy of atom  2       EATOM= -257.1286
 kinetic energy error for atom=    0.0007 (will be added to EATOM!!)
  PAW_PBE N 08Apr2002                   :
 energy of atom  3       EATOM= -264.5486
 kinetic energy error for atom=    0.0125 (will be added to EATOM!!)
  PAW_PBE Sr_sv 07Sep2000               :
 energy of atom  4       EATOM= -843.0319
 kinetic energy error for atom=    0.0010 (will be added to EATOM!!)
 
 
 POSCAR: 11                                      
  positions in direct lattice
  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  0.000  0.000  0.594-   2 2.74   2 2.74   2 2.74   3 2.91   3 2.91   3 2.91   5 3.96
   2  0.667  0.333  0.633-   1 2.74   1 2.74   1 2.74
   3  0.333  0.667  0.548-   1 2.91   1 2.91   1 2.91   5 3.14   5 3.14   5 3.14
   4  0.667  0.333  0.454-   6 2.55   6 2.55   6 2.55   5 2.76   5 2.76   5 2.76
   5  0.000  0.000  0.493-   4 2.76   4 2.76   4 2.76   3 3.14   3 3.14   3 3.14   6 3.54   6 3.54
                             6 3.54   1 3.96
   6  0.333  0.667  0.425-   4 2.55   4 2.55   4 2.55   5 3.54   5 3.54   5 3.54
 
  LATTYP: Found a hexagonal cell.
 ALAT       =     3.9501156202
 C/A-ratio  =     9.9749454402
  
  Lattice vectors:
  
 A1 = (   3.9501156207,   0.0000000002,   0.0000000000)
 A2 = (  -1.9750578097,   3.4209004743,   0.0000000000)
 A3 = (  -0.0000000000,   0.0000000000,  39.4021877938)


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 
 hexagonal supercell.


 Subroutine GETGRP returns: Found  6 space group operations
 (whereof  6 operations were pure point group operations)
 out of a pool of 24 trial point group operations.


The static configuration has the point symmetry C_3v.


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 
 hexagonal supercell.


 Subroutine GETGRP returns: Found  6 space group operations
 (whereof  6 operations were pure point group operations)
 out of a pool of 24 trial point group operations.


The dynamic configuration has the point symmetry C_3v.


Analysis of structural, dynamic, and magnetic symmetry:
=====================================================================
 Subroutine PRICEL returns:
 Original cell was already a primitive cell.
 

 Routine SETGRP: Setting up the symmetry group for a 
 hexagonal supercell.


 Subroutine GETGRP returns: Found  1 space group operations
 (whereof  1 operations were pure point group operations)
 out of a pool of 24 trial point group operations.


The (compounded) 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

 
 
 KPOINTS: K-Path Generated by VASPKIT.            
  interpolating k-points between supplied coordinates
  k-points in reciprocal lattice
Space group operators:
 irot       det(A)        alpha          n_x          n_y          n_z        tau_x        tau_y        tau_z
    1     1.000000     0.000001     1.000000     0.000000     0.000000     0.000000     0.000000     0.000000


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




 Dimension of arrays:
   k-points           NKPTS =    150   k-points in BZ     NKDIM =    150   number of bands    NBANDS=     72
   number of dos      NEDOS =    301   number of ions     NIONS =      6
   non local maximal  LDIM  =      6   non local SUM 2l+1 LMDIM =     18
   total plane-waves  NPLWV = 264600
   max r-space proj   IRMAX =      1   max aug-charges    IRDMAX=  29336
   dimension x,y,z NGX =    30 NGY =   30 NGZ =  294
   dimension x,y,z NGXF=    60 NGYF=   60 NGZF=  588
   support grid    NGXF=    60 NGYF=   60 NGZF=  588
   ions per type =               1   2   1   2
   NGX,Y,Z   is equivalent  to a cutoff of  12.63, 12.63, 12.40 a.u.
   NGXF,Y,Z  is equivalent  to a cutoff of  25.25, 25.25, 24.81 a.u.

 SYSTEM =  SnS2                                    
 POSCAR =  11                                      

 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 =     11    charge: 1-file 2-atom 10-const
   ISPIN  =      1    spin polarized calculation?
   LNONCOLLINEAR =      T non collinear calculations
   LSORBIT =      T    spin-orbit coupling
   INIWAV =      1    electr: 0-lowe 1-rand  2-diag
   LASPH  =      T    aspherical Exc in radial PAW
   METAGGA=      F    non-selfconsistent MetaGGA calc.

 Electronic Relaxation 1
   ENCUT  =  520.0 eV  38.22 Ry    6.18 a.u.   7.34  7.34 73.26*2*pi/ulx,y,z
   ENINI  =  520.0     initial cutoff
   ENAUG  =  627.1 eV  augmentation charge cutoff
   NELM   =    160;   NELMIN=  4; NELMDL= -5     # of ELM steps 
   EDIFF  = 0.1E-05   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     =    4 max onsite mixed and CHGCAR
   VOSKOWN=      1    Vosko Wilk Nusair interpolation
   ROPT   =    0.00000   0.00000   0.00000   0.00000
 Ionic relaxation
   EDIFFG = 0.1E-04   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   =      2    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=  -0.357E-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 = 118.71 78.96 14.00 87.62
  Ionic Valenz
   ZVAL   =  14.00  6.00  5.00 10.00
  Atomic Wigner-Seitz radii
   RWIGS  =  -1.00 -1.00 -1.00 -1.00
  virtual crystal weights 
   VCA    =   1.00  1.00  1.00  1.00
   NELECT =      51.0000    total number of electrons
   NUPDOWN=      -1.0000    fix difference up-down

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

 Electronic relaxation 2 (details)
   IALGO  =     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     =   0.10;   BMIX     =  0.00
     AMIX_MAG =   0.40;   BMIX_MAG =  0.00
     AMIN     =   0.10
     WC   =   100.;   INIMIX=   1;  MIXPRE=   1;  MAXMIX=  80

 Intra band minimization:
   WEIMIN = 0.0000     energy-eigenvalue tresh-hold
   EBREAK =  0.35E-08  absolut break condition
   DEPER  =   0.30     relativ break condition  

   TIME   =   0.40     timestep for ELM

  volume/ion in A,a.u.               =      88.74       598.85
  Fermi-wavevector in a.u.,A,eV,Ry     =   0.749045  1.415490  7.633803  0.561069
  Thomas-Fermi vector in A             =   1.845474
 
 Write flags
   LWAVE        =      F    write WAVECAR
   LDOWNSAMPLE  =      F    k-point downsampling of WAVECAR
   LCHARG       =      F    write CHGCAR
   LVTOT        =      T    write LOCPOT, total local potential
   LVHAR        =      F    write LOCPOT, Hartree potential only
   LELF         =      F    write electronic localiz. function (ELF)
   LORBIT       =     11    0 simple, 1 ext, 2 COOP (PROOUT), +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     =    PE    GGA type
   LEXCH   =     8    internal setting for exchange type
   VOSKOWN=      1    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 remain constant during run
 non collinear spin polarized calculation
 Variant of blocked Davidson
 Davidson routine will perform the subspace rotation
 perform sub-space diagonalisation
    after iterative eigenvector-optimisation
 no mixing
 using additional bands           46
 reciprocal scheme for non local part
 use partial core corrections
 calculate Harris-corrections to forces 
   (improved forces if not selfconsistent)
 use gradient corrections 
 WARNING: stress and forces are not correct
  (second derivative of E(xc) not defined)
 use of overlap-Matrix (Vanderbilt PP)
 Gauss-broadening in eV      SIGMA  =   0.05


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


  energy-cutoff  :      520.00
  volume of cell :      532.44
      direct lattice vectors                 reciprocal lattice vectors
     3.950115621  0.000000000  0.000000000     0.253157147  0.146160347 -0.000000000
    -1.975057810  3.420900474  0.000000000    -0.000000000  0.292320694 -0.000000000
    -0.000000000  0.000000000 39.402187794     0.000000000  0.000000000  0.025379301

  length of vectors
     3.950115621  3.950115619 39.402187794     0.292320694  0.292320694  0.025379301


 
 k-points in units of 2pi/SCALE and weight: K-Path Generated by VASPKIT.            
   0.00000000  0.00000000  0.00000000       0.007
   0.00258324  0.00149143 -0.00000000       0.007
   0.00516647  0.00298286 -0.00000000       0.007
   0.00774971  0.00447430 -0.00000000       0.007
   0.01033294  0.00596573 -0.00000000       0.007
   0.01291618  0.00745716 -0.00000000       0.007
   0.01549942  0.00894859 -0.00000000       0.007
   0.01808265  0.01044002 -0.00000000       0.007
   0.02066589  0.01193146 -0.00000000       0.007
   0.02324913  0.01342289 -0.00000000       0.007
   0.02583236  0.01491432 -0.00000000       0.007
   0.02841560  0.01640575 -0.00000000       0.007
   0.03099883  0.01789719 -0.00000000       0.007
   0.03358207  0.01938862 -0.00000000       0.007
   0.03616531  0.02088005 -0.00000000       0.007
   0.03874854  0.02237148 -0.00000000       0.007
   0.04133178  0.02386291 -0.00000000       0.007
   0.04391502  0.02535435 -0.00000000       0.007
   0.04649825  0.02684578 -0.00000000       0.007
   0.04908149  0.02833721 -0.00000000       0.007
   0.05166472  0.02982864 -0.00000000       0.007
   0.05424796  0.03132007 -0.00000000       0.007
   0.05683120  0.03281151 -0.00000000       0.007
   0.05941443  0.03430294 -0.00000000       0.007
   0.06199767  0.03579437 -0.00000000       0.007
   0.06458090  0.03728580 -0.00000000       0.007
   0.06716414  0.03877723 -0.00000000       0.007
   0.06974738  0.04026867 -0.00000000       0.007
   0.07233061  0.04176010 -0.00000000       0.007
   0.07491385  0.04325153 -0.00000000       0.007
   0.07749709  0.04474296 -0.00000000       0.007
   0.08008032  0.04623440 -0.00000000       0.007
   0.08266356  0.04772583 -0.00000000       0.007
   0.08524679  0.04921726 -0.00000000       0.007
   0.08783003  0.05070869 -0.00000000       0.007
   0.09041327  0.05220012 -0.00000000       0.007
   0.09299650  0.05369156 -0.00000000       0.007
   0.09557974  0.05518299 -0.00000000       0.007
   0.09816298  0.05667442 -0.00000000       0.007
   0.10074621  0.05816585 -0.00000000       0.007
   0.10332945  0.05965728 -0.00000000       0.007
   0.10591268  0.06114872 -0.00000000       0.007
   0.10849592  0.06264015 -0.00000000       0.007
   0.11107916  0.06413158 -0.00000000       0.007
   0.11366239  0.06562301 -0.00000000       0.007
   0.11624563  0.06711444 -0.00000000       0.007
   0.11882886  0.06860588 -0.00000000       0.007
   0.12141210  0.07009731 -0.00000000       0.007
   0.12399534  0.07158874 -0.00000000       0.007
   0.12657857  0.07308017 -0.00000000       0.007
   0.12657857  0.07308017 -0.00000000       0.007
   0.12571749  0.07457161 -0.00000000       0.007
   0.12485642  0.07606304 -0.00000000       0.007
   0.12399534  0.07755447 -0.00000000       0.007
   0.12313426  0.07904590 -0.00000000       0.007
   0.12227318  0.08053733 -0.00000000       0.007
   0.12141210  0.08202877 -0.00000000       0.007
   0.12055102  0.08352020 -0.00000000       0.007
   0.11968994  0.08501163 -0.00000000       0.007
   0.11882886  0.08650306 -0.00000000       0.007
   0.11796779  0.08799449 -0.00000000       0.007
   0.11710671  0.08948593 -0.00000000       0.007
   0.11624563  0.09097736 -0.00000000       0.007
   0.11538455  0.09246879 -0.00000000       0.007
   0.11452347  0.09396022 -0.00000000       0.007
   0.11366239  0.09545166 -0.00000000       0.007
   0.11280131  0.09694309 -0.00000000       0.007
   0.11194023  0.09843452 -0.00000000       0.007
   0.11107916  0.09992595 -0.00000000       0.007
   0.11021808  0.10141738 -0.00000000       0.007
   0.10935700  0.10290882 -0.00000000       0.007
   0.10849592  0.10440025 -0.00000000       0.007
   0.10763484  0.10589168 -0.00000000       0.007
   0.10677376  0.10738311 -0.00000000       0.007
   0.10591268  0.10887454 -0.00000000       0.007
   0.10505161  0.11036598 -0.00000000       0.007
   0.10419053  0.11185741 -0.00000000       0.007
   0.10332945  0.11334884 -0.00000000       0.007
   0.10246837  0.11484027 -0.00000000       0.007
   0.10160729  0.11633170 -0.00000000       0.007
   0.10074621  0.11782314 -0.00000000       0.007
   0.09988513  0.11931457 -0.00000000       0.007
   0.09902405  0.12080600 -0.00000000       0.007
   0.09816298  0.12229743 -0.00000000       0.007
   0.09730190  0.12378887 -0.00000000       0.007
   0.09644082  0.12528030 -0.00000000       0.007
   0.09557974  0.12677173 -0.00000000       0.007
   0.09471866  0.12826316 -0.00000000       0.007
   0.09385758  0.12975459 -0.00000000       0.007
   0.09299650  0.13124603 -0.00000000       0.007
   0.09213542  0.13273746 -0.00000000       0.007
   0.09127435  0.13422889 -0.00000000       0.007
   0.09041327  0.13572032 -0.00000000       0.007
   0.08955219  0.13721175 -0.00000000       0.007
   0.08869111  0.13870319 -0.00000000       0.007
   0.08783003  0.14019462 -0.00000000       0.007
   0.08696895  0.14168605 -0.00000000       0.007
   0.08610787  0.14317748 -0.00000000       0.007
   0.08524679  0.14466891 -0.00000000       0.007
   0.08438572  0.14616035 -0.00000000       0.007
   0.08438572  0.14616035 -0.00000000       0.007
   0.08266356  0.14317748 -0.00000000       0.007
   0.08094140  0.14019462 -0.00000000       0.007
   0.07921924  0.13721175 -0.00000000       0.007
   0.07749709  0.13422889 -0.00000000       0.007
   0.07577493  0.13124603 -0.00000000       0.007
   0.07405277  0.12826316 -0.00000000       0.007
   0.07233061  0.12528030 -0.00000000       0.007
   0.07060846  0.12229743 -0.00000000       0.007
   0.06888630  0.11931457 -0.00000000       0.007
   0.06716414  0.11633170 -0.00000000       0.007
   0.06544198  0.11334884 -0.00000000       0.007
   0.06371983  0.11036598 -0.00000000       0.007
   0.06199767  0.10738311 -0.00000000       0.007
   0.06027551  0.10440025 -0.00000000       0.007
   0.05855335  0.10141738 -0.00000000       0.007
   0.05683120  0.09843452 -0.00000000       0.007
   0.05510904  0.09545166 -0.00000000       0.007
   0.05338688  0.09246879 -0.00000000       0.007
   0.05166472  0.08948593 -0.00000000       0.007
   0.04994257  0.08650306 -0.00000000       0.007
   0.04822041  0.08352020 -0.00000000       0.007
   0.04649825  0.08053733 -0.00000000       0.007
   0.04477609  0.07755447 -0.00000000       0.007
   0.04305394  0.07457161 -0.00000000       0.007
   0.04133178  0.07158874 -0.00000000       0.007
   0.03960962  0.06860588 -0.00000000       0.007
   0.03788746  0.06562301 -0.00000000       0.007
   0.03616531  0.06264015 -0.00000000       0.007
   0.03444315  0.05965728 -0.00000000       0.007
   0.03272099  0.05667442 -0.00000000       0.007
   0.03099883  0.05369156 -0.00000000       0.007
   0.02927668  0.05070869 -0.00000000       0.007
   0.02755452  0.04772583 -0.00000000       0.007
   0.02583236  0.04474296 -0.00000000       0.007
   0.02411020  0.04176010 -0.00000000       0.007
   0.02238805  0.03877723 -0.00000000       0.007
   0.02066589  0.03579437 -0.00000000       0.007
   0.01894373  0.03281151 -0.00000000       0.007
   0.01722157  0.02982864 -0.00000000       0.007
   0.01549942  0.02684578 -0.00000000       0.007
   0.01377726  0.02386291 -0.00000000       0.007
   0.01205510  0.02088005 -0.00000000       0.007
   0.01033294  0.01789719 -0.00000000       0.007
   0.00861079  0.01491432 -0.00000000       0.007
   0.00688863  0.01193146 -0.00000000       0.007
   0.00516647  0.00894859 -0.00000000       0.007
   0.00344431  0.00596573 -0.00000000       0.007
   0.00172216  0.00298286 -0.00000000       0.007
   0.00000000  0.00000000  0.00000000       0.007
 
 k-points in reciprocal lattice and weights: K-Path Generated by VASPKIT.            
   0.00000000  0.00000000  0.00000000       0.007
   0.01020408  0.00000000  0.00000000       0.007
   0.02040816  0.00000000  0.00000000       0.007
   0.03061224  0.00000000  0.00000000       0.007
   0.04081633  0.00000000  0.00000000       0.007
   0.05102041  0.00000000  0.00000000       0.007
   0.06122449  0.00000000  0.00000000       0.007
   0.07142857  0.00000000  0.00000000       0.007
   0.08163265  0.00000000  0.00000000       0.007
   0.09183673  0.00000000  0.00000000       0.007
   0.10204082  0.00000000  0.00000000       0.007
   0.11224490  0.00000000  0.00000000       0.007
   0.12244898  0.00000000  0.00000000       0.007
   0.13265306  0.00000000  0.00000000       0.007
   0.14285714  0.00000000  0.00000000       0.007
   0.15306122  0.00000000  0.00000000       0.007
   0.16326531  0.00000000  0.00000000       0.007
   0.17346939  0.00000000  0.00000000       0.007
   0.18367347  0.00000000  0.00000000       0.007
   0.19387755  0.00000000  0.00000000       0.007
   0.20408163  0.00000000  0.00000000       0.007
   0.21428571  0.00000000  0.00000000       0.007
   0.22448980  0.00000000  0.00000000       0.007
   0.23469388  0.00000000  0.00000000       0.007
   0.24489796  0.00000000  0.00000000       0.007
   0.25510204  0.00000000  0.00000000       0.007
   0.26530612  0.00000000  0.00000000       0.007
   0.27551020  0.00000000  0.00000000       0.007
   0.28571429  0.00000000  0.00000000       0.007
   0.29591837  0.00000000  0.00000000       0.007
   0.30612245  0.00000000  0.00000000       0.007
   0.31632653  0.00000000  0.00000000       0.007
   0.32653061  0.00000000  0.00000000       0.007
   0.33673469  0.00000000  0.00000000       0.007
   0.34693878  0.00000000  0.00000000       0.007
   0.35714286  0.00000000  0.00000000       0.007
   0.36734694  0.00000000  0.00000000       0.007
   0.37755102  0.00000000  0.00000000       0.007
   0.38775510  0.00000000  0.00000000       0.007
   0.39795918  0.00000000  0.00000000       0.007
   0.40816327  0.00000000  0.00000000       0.007
   0.41836735  0.00000000  0.00000000       0.007
   0.42857143  0.00000000  0.00000000       0.007
   0.43877551  0.00000000  0.00000000       0.007
   0.44897959  0.00000000  0.00000000       0.007
   0.45918367  0.00000000  0.00000000       0.007
   0.46938776  0.00000000  0.00000000       0.007
   0.47959184  0.00000000  0.00000000       0.007
   0.48979592  0.00000000  0.00000000       0.007
   0.50000000  0.00000000  0.00000000       0.007
   0.50000000  0.00000000  0.00000000       0.007
   0.49659864  0.00680272  0.00000000       0.007
   0.49319728  0.01360544  0.00000000       0.007
   0.48979592  0.02040816  0.00000000       0.007
   0.48639456  0.02721088  0.00000000       0.007
   0.48299320  0.03401361  0.00000000       0.007
   0.47959184  0.04081633  0.00000000       0.007
   0.47619048  0.04761905  0.00000000       0.007
   0.47278912  0.05442177  0.00000000       0.007
   0.46938776  0.06122449  0.00000000       0.007
   0.46598639  0.06802721  0.00000000       0.007
   0.46258503  0.07482993  0.00000000       0.007
   0.45918367  0.08163265  0.00000000       0.007
   0.45578231  0.08843537  0.00000000       0.007
   0.45238095  0.09523810  0.00000000       0.007
   0.44897959  0.10204082  0.00000000       0.007
   0.44557823  0.10884354  0.00000000       0.007
   0.44217687  0.11564626  0.00000000       0.007
   0.43877551  0.12244898  0.00000000       0.007
   0.43537415  0.12925170  0.00000000       0.007
   0.43197279  0.13605442  0.00000000       0.007
   0.42857143  0.14285714  0.00000000       0.007
   0.42517007  0.14965986  0.00000000       0.007
   0.42176871  0.15646259  0.00000000       0.007
   0.41836735  0.16326531  0.00000000       0.007
   0.41496599  0.17006803  0.00000000       0.007
   0.41156463  0.17687075  0.00000000       0.007
   0.40816327  0.18367347  0.00000000       0.007
   0.40476190  0.19047619  0.00000000       0.007
   0.40136054  0.19727891  0.00000000       0.007
   0.39795918  0.20408163  0.00000000       0.007
   0.39455782  0.21088435  0.00000000       0.007
   0.39115646  0.21768707  0.00000000       0.007
   0.38775510  0.22448980  0.00000000       0.007
   0.38435374  0.23129252  0.00000000       0.007
   0.38095238  0.23809524  0.00000000       0.007
   0.37755102  0.24489796  0.00000000       0.007
   0.37414966  0.25170068  0.00000000       0.007
   0.37074830  0.25850340  0.00000000       0.007
   0.36734694  0.26530612  0.00000000       0.007
   0.36394558  0.27210884  0.00000000       0.007
   0.36054422  0.27891156  0.00000000       0.007
   0.35714286  0.28571429  0.00000000       0.007
   0.35374150  0.29251701  0.00000000       0.007
   0.35034014  0.29931973  0.00000000       0.007
   0.34693878  0.30612245  0.00000000       0.007
   0.34353741  0.31292517  0.00000000       0.007
   0.34013605  0.31972789  0.00000000       0.007
   0.33673469  0.32653061  0.00000000       0.007
   0.33333333  0.33333333  0.00000000       0.007
   0.33333333  0.33333333  0.00000000       0.007
   0.32653061  0.32653061  0.00000000       0.007
   0.31972789  0.31972789  0.00000000       0.007
   0.31292517  0.31292517  0.00000000       0.007
   0.30612245  0.30612245  0.00000000       0.007
   0.29931973  0.29931973  0.00000000       0.007
   0.29251701  0.29251701  0.00000000       0.007
   0.28571429  0.28571429  0.00000000       0.007
   0.27891156  0.27891156  0.00000000       0.007
   0.27210884  0.27210884  0.00000000       0.007
   0.26530612  0.26530612  0.00000000       0.007
   0.25850340  0.25850340  0.00000000       0.007
   0.25170068  0.25170068  0.00000000       0.007
   0.24489796  0.24489796  0.00000000       0.007
   0.23809524  0.23809524  0.00000000       0.007
   0.23129252  0.23129252  0.00000000       0.007
   0.22448980  0.22448980  0.00000000       0.007
   0.21768707  0.21768707  0.00000000       0.007
   0.21088435  0.21088435  0.00000000       0.007
   0.20408163  0.20408163  0.00000000       0.007
   0.19727891  0.19727891  0.00000000       0.007
   0.19047619  0.19047619  0.00000000       0.007
   0.18367347  0.18367347  0.00000000       0.007
   0.17687075  0.17687075  0.00000000       0.007
   0.17006803  0.17006803  0.00000000       0.007
   0.16326531  0.16326531  0.00000000       0.007
   0.15646259  0.15646259  0.00000000       0.007
   0.14965986  0.14965986  0.00000000       0.007
   0.14285714  0.14285714  0.00000000       0.007
   0.13605442  0.13605442  0.00000000       0.007
   0.12925170  0.12925170  0.00000000       0.007
   0.12244898  0.12244898  0.00000000       0.007
   0.11564626  0.11564626  0.00000000       0.007
   0.10884354  0.10884354  0.00000000       0.007
   0.10204082  0.10204082  0.00000000       0.007
   0.09523810  0.09523810  0.00000000       0.007
   0.08843537  0.08843537  0.00000000       0.007
   0.08163265  0.08163265  0.00000000       0.007
   0.07482993  0.07482993  0.00000000       0.007
   0.06802721  0.06802721  0.00000000       0.007
   0.06122449  0.06122449  0.00000000       0.007
   0.05442177  0.05442177  0.00000000       0.007
   0.04761905  0.04761905  0.00000000       0.007
   0.04081633  0.04081633  0.00000000       0.007
   0.03401361  0.03401361  0.00000000       0.007
   0.02721088  0.02721088  0.00000000       0.007
   0.02040816  0.02040816  0.00000000       0.007
   0.01360544  0.01360544  0.00000000       0.007
   0.00680272  0.00680272  0.00000000       0.007
   0.00000000  0.00000000  0.00000000       0.007
 
 position of ions in fractional coordinates (direct lattice) 
   0.00000000  0.00000000  0.59402120
   0.66666667  0.33333333  0.63257356
   0.33333333  0.66666667  0.54818992
   0.66666667  0.33333333  0.45397341
   0.00000000  0.00000000  0.49342546
   0.33333333  0.66666667  0.42480646
 
 position of ions in cartesian coordinates  (Angst):
  -0.00000000  0.00000000 23.40573491
   1.97505781  1.14030016 24.92478209
  -0.00000000  2.28060032 21.59988207
   1.97505781  1.14030016 17.88754548
  -0.00000000  0.00000000 19.44204253
  -0.00000000  2.28060032 16.73830396
 
 Euler angles ALPHA=     0.0000000  BETA=     0.0000000

 transformation matrix from SAXIS to cartesian coordinates
 ---------------------------------------------------------
     1.0000000 m_x     0.0000000 m_y     0.0000000 m_z
     0.0000000 m_x     1.0000000 m_y     0.0000000 m_z
     0.0000000 m_x     0.0000000 m_y     1.0000000 m_z

 transformation matrix from cartesian coordinates to SAXIS
 ---------------------------------------------------------
     1.0000000 m_x     0.0000000 m_y     0.0000000 m_z
     0.0000000 m_x     1.0000000 m_y     0.0000000 m_z
     0.0000000 m_x     0.0000000 m_y     1.0000000 m_z




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


 k-point  1 :   0.0000 0.0000 0.0000  plane waves:   28890
 k-point  2 :   0.0102 0.0000 0.0000  plane waves:   28922
 k-point  3 :   0.0204 0.0000 0.0000  plane waves:   28894
 k-point  4 :   0.0306 0.0000 0.0000  plane waves:   28938
 k-point  5 :   0.0408 0.0000 0.0000  plane waves:   28886
 k-point  6 :   0.0510 0.0000 0.0000  plane waves:   28882
 k-point  7 :   0.0612 0.0000 0.0000  plane waves:   28886
 k-point  8 :   0.0714 0.0000 0.0000  plane waves:   28846
 k-point  9 :   0.0816 0.0000 0.0000  plane waves:   28862
 k-point 10 :   0.0918 0.0000 0.0000  plane waves:   28886
 k-point 11 :   0.1020 0.0000 0.0000  plane waves:   28850
 k-point 12 :   0.1122 0.0000 0.0000  plane waves:   28858
 k-point 13 :   0.1224 0.0000 0.0000  plane waves:   28806
 k-point 14 :   0.1327 0.0000 0.0000  plane waves:   28818
 k-point 15 :   0.1429 0.0000 0.0000  plane waves:   28814
 k-point 16 :   0.1531 0.0000 0.0000  plane waves:   28758
 k-point 17 :   0.1633 0.0000 0.0000  plane waves:   28734
 k-point 18 :   0.1735 0.0000 0.0000  plane waves:   28714
 k-point 19 :   0.1837 0.0000 0.0000  plane waves:   28678
 k-point 20 :   0.1939 0.0000 0.0000  plane waves:   28698
 k-point 21 :   0.2041 0.0000 0.0000  plane waves:   28714
 k-point 22 :   0.2143 0.0000 0.0000  plane waves:   28722
 k-point 23 :   0.2245 0.0000 0.0000  plane waves:   28730
 k-point 24 :   0.2347 0.0000 0.0000  plane waves:   28698
 k-point 25 :   0.2449 0.0000 0.0000  plane waves:   28702
 k-point 26 :   0.2551 0.0000 0.0000  plane waves:   28730
 k-point 27 :   0.2653 0.0000 0.0000  plane waves:   28702
 k-point 28 :   0.2755 0.0000 0.0000  plane waves:   28706
 k-point 29 :   0.2857 0.0000 0.0000  plane waves:   28710
 k-point 30 :   0.2959 0.0000 0.0000  plane waves:   28674
 k-point 31 :   0.3061 0.0000 0.0000  plane waves:   28654
 k-point 32 :   0.3163 0.0000 0.0000  plane waves:   28634
 k-point 33 :   0.3265 0.0000 0.0000  plane waves:   28618
 k-point 34 :   0.3367 0.0000 0.0000  plane waves:   28602
 k-point 35 :   0.3469 0.0000 0.0000  plane waves:   28618
 k-point 36 :   0.3571 0.0000 0.0000  plane waves:   28618
 k-point 37 :   0.3673 0.0000 0.0000  plane waves:   28616
 k-point 38 :   0.3776 0.0000 0.0000  plane waves:   28648
 k-point 39 :   0.3878 0.0000 0.0000  plane waves:   28644
 k-point 40 :   0.3980 0.0000 0.0000  plane waves:   28644
 k-point 41 :   0.4082 0.0000 0.0000  plane waves:   28612
 k-point 42 :   0.4184 0.0000 0.0000  plane waves:   28608
 k-point 43 :   0.4286 0.0000 0.0000  plane waves:   28624
 k-point 44 :   0.4388 0.0000 0.0000  plane waves:   28628
 k-point 45 :   0.4490 0.0000 0.0000  plane waves:   28604
 k-point 46 :   0.4592 0.0000 0.0000  plane waves:   28612
 k-point 47 :   0.4694 0.0000 0.0000  plane waves:   28644
 k-point 48 :   0.4796 0.0000 0.0000  plane waves:   28624
 k-point 49 :   0.4898 0.0000 0.0000  plane waves:   28620
 k-point 50 :   0.5000 0.0000 0.0000  plane waves:   28592
 k-point 51 :   0.5000 0.0000 0.0000  plane waves:   28592
 k-point 52 :   0.4966 0.0068 0.0000  plane waves:   28620
 k-point 53 :   0.4932 0.0136 0.0000  plane waves:   28636
 k-point 54 :   0.4898 0.0204 0.0000  plane waves:   28636
 k-point 55 :   0.4864 0.0272 0.0000  plane waves:   28632
 k-point 56 :   0.4830 0.0340 0.0000  plane waves:   28672
 k-point 57 :   0.4796 0.0408 0.0000  plane waves:   28664
 k-point 58 :   0.4762 0.0476 0.0000  plane waves:   28640
 k-point 59 :   0.4728 0.0544 0.0000  plane waves:   28648
 k-point 60 :   0.4694 0.0612 0.0000  plane waves:   28668
 k-point 61 :   0.4660 0.0680 0.0000  plane waves:   28672
 k-point 62 :   0.4626 0.0748 0.0000  plane waves:   28660
 k-point 63 :   0.4592 0.0816 0.0000  plane waves:   28652
 k-point 64 :   0.4558 0.0884 0.0000  plane waves:   28684
 k-point 65 :   0.4524 0.0952 0.0000  plane waves:   28672
 k-point 66 :   0.4490 0.1020 0.0000  plane waves:   28676
 k-point 67 :   0.4456 0.1088 0.0000  plane waves:   28660
 k-point 68 :   0.4422 0.1156 0.0000  plane waves:   28652
 k-point 69 :   0.4388 0.1224 0.0000  plane waves:   28656
 k-point 70 :   0.4354 0.1293 0.0000  plane waves:   28656
 k-point 71 :   0.4320 0.1361 0.0000  plane waves:   28640
 k-point 72 :   0.4286 0.1429 0.0000  plane waves:   28616
 k-point 73 :   0.4252 0.1497 0.0000  plane waves:   28624
 k-point 74 :   0.4218 0.1565 0.0000  plane waves:   28632
 k-point 75 :   0.4184 0.1633 0.0000  plane waves:   28616
 k-point 76 :   0.4150 0.1701 0.0000  plane waves:   28620
 k-point 77 :   0.4116 0.1769 0.0000  plane waves:   28644
 k-point 78 :   0.4082 0.1837 0.0000  plane waves:   28628
 k-point 79 :   0.4048 0.1905 0.0000  plane waves:   28604
 k-point 80 :   0.4014 0.1973 0.0000  plane waves:   28604
 k-point 81 :   0.3980 0.2041 0.0000  plane waves:   28612
 k-point 82 :   0.3946 0.2109 0.0000  plane waves:   28624
 k-point 83 :   0.3912 0.2177 0.0000  plane waves:   28620
 k-point 84 :   0.3878 0.2245 0.0000  plane waves:   28604
 k-point 85 :   0.3844 0.2313 0.0000  plane waves:   28552
 k-point 86 :   0.3810 0.2381 0.0000  plane waves:   28552
 k-point 87 :   0.3776 0.2449 0.0000  plane waves:   28560
 k-point 88 :   0.3741 0.2517 0.0000  plane waves:   28556
 k-point 89 :   0.3707 0.2585 0.0000  plane waves:   28548
 k-point 90 :   0.3673 0.2653 0.0000  plane waves:   28564
 k-point 91 :   0.3639 0.2721 0.0000  plane waves:   28568
 k-point 92 :   0.3605 0.2789 0.0000  plane waves:   28568
 k-point 93 :   0.3571 0.2857 0.0000  plane waves:   28576
 k-point 94 :   0.3537 0.2925 0.0000  plane waves:   28596
 k-point 95 :   0.3503 0.2993 0.0000  plane waves:   28604
 k-point 96 :   0.3469 0.3061 0.0000  plane waves:   28596
 k-point 97 :   0.3435 0.3129 0.0000  plane waves:   28588
 k-point 98 :   0.3401 0.3197 0.0000  plane waves:   28596
 k-point 99 :   0.3367 0.3265 0.0000  plane waves:   28608
 k-point ** :   0.3333 0.3333 0.0000  plane waves:   28620
 k-point ** :   0.3333 0.3333 0.0000  plane waves:   28620
 k-point ** :   0.3265 0.3265 0.0000  plane waves:   28606
 k-point ** :   0.3197 0.3197 0.0000  plane waves:   28634
 k-point ** :   0.3129 0.3129 0.0000  plane waves:   28630
 k-point ** :   0.3061 0.3061 0.0000  plane waves:   28614
 k-point ** :   0.2993 0.2993 0.0000  plane waves:   28598
 k-point ** :   0.2925 0.2925 0.0000  plane waves:   28590
 k-point ** :   0.2857 0.2857 0.0000  plane waves:   28574
 k-point ** :   0.2789 0.2789 0.0000  plane waves:   28558
 k-point ** :   0.2721 0.2721 0.0000  plane waves:   28562
 k-point ** :   0.2653 0.2653 0.0000  plane waves:   28578
 k-point ** :   0.2585 0.2585 0.0000  plane waves:   28586
 k-point ** :   0.2517 0.2517 0.0000  plane waves:   28630
 k-point ** :   0.2449 0.2449 0.0000  plane waves:   28606
 k-point ** :   0.2381 0.2381 0.0000  plane waves:   28622
 k-point ** :   0.2313 0.2313 0.0000  plane waves:   28634
 k-point ** :   0.2245 0.2245 0.0000  plane waves:   28666
 k-point ** :   0.2177 0.2177 0.0000  plane waves:   28662
 k-point ** :   0.2109 0.2109 0.0000  plane waves:   28682
 k-point ** :   0.2041 0.2041 0.0000  plane waves:   28698
 k-point ** :   0.1973 0.1973 0.0000  plane waves:   28718
 k-point ** :   0.1905 0.1905 0.0000  plane waves:   28750
 k-point ** :   0.1837 0.1837 0.0000  plane waves:   28718
 k-point ** :   0.1769 0.1769 0.0000  plane waves:   28686
 k-point ** :   0.1701 0.1701 0.0000  plane waves:   28718
 k-point ** :   0.1633 0.1633 0.0000  plane waves:   28754
 k-point ** :   0.1565 0.1565 0.0000  plane waves:   28750
 k-point ** :   0.1497 0.1497 0.0000  plane waves:   28742
 k-point ** :   0.1429 0.1429 0.0000  plane waves:   28722
 k-point ** :   0.1361 0.1361 0.0000  plane waves:   28706
 k-point ** :   0.1293 0.1293 0.0000  plane waves:   28714
 k-point ** :   0.1224 0.1224 0.0000  plane waves:   28674
 k-point ** :   0.1156 0.1156 0.0000  plane waves:   28674
 k-point ** :   0.1088 0.1088 0.0000  plane waves:   28722
 k-point ** :   0.1020 0.1020 0.0000  plane waves:   28718
 k-point ** :   0.0952 0.0952 0.0000  plane waves:   28730
 k-point ** :   0.0884 0.0884 0.0000  plane waves:   28758
 k-point ** :   0.0816 0.0816 0.0000  plane waves:   28786
 k-point ** :   0.0748 0.0748 0.0000  plane waves:   28766
 k-point ** :   0.0680 0.0680 0.0000  plane waves:   28810
 k-point ** :   0.0612 0.0612 0.0000  plane waves:   28854
 k-point ** :   0.0544 0.0544 0.0000  plane waves:   28870
 k-point ** :   0.0476 0.0476 0.0000  plane waves:   28870
 k-point ** :   0.0408 0.0408 0.0000  plane waves:   28862
 k-point ** :   0.0340 0.0340 0.0000  plane waves:   28870
 k-point ** :   0.0272 0.0272 0.0000  plane waves:   28890
 k-point ** :   0.0204 0.0204 0.0000  plane waves:   28902
 k-point ** :   0.0136 0.0136 0.0000  plane waves:   28902
 k-point ** :   0.0068 0.0068 0.0000  plane waves:   28906
 k-point ** :   0.0000 0.0000 0.0000  plane waves:   28890

 maximum and minimum number of plane-waves per node :     28938    28548

 maximum number of plane-waves:     28938
 maximum index in each direction: 
   IXMAX=    7   IYMAX=    7   IZMAX=   73
   IXMIN=   -7   IYMIN=   -7   IZMIN=  -73


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


 total amount of memory used by VASP MPI-rank0  2042483. kBytes
=======================================================================

   base      :      30000. kBytes
   nonl-proj :    1251770. kBytes
   fftplans  :      20710. kBytes
   grid      :     110638. kBytes
   one-center:        373. kBytes
   wavefun   :     628992. kBytes
 
     INWAV:  cpu time    0.0001: real time    0.0001
 initial charge density was supplied:
 number of electron      51.0000005 magnetization       0.0016946      0.0167322      0.0001207
 keeping initial charge density in first step


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


 Maximum index for augmentation-charges         4042 (set IRDMAX)


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


 First call to EWALD:  gamma=   0.219
 Maximum number of real-space cells 6x 6x 1
 Maximum number of reciprocal cells 2x 2x11

    FEWALD:  cpu time    0.0169: real time    0.0170


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


    POTLOK:  cpu time    2.2595: real time    2.2810
    SETDIJ:  cpu time    1.1973: real time    1.2001
     EDDAV:  cpu time  130.9637: real time  131.2472
       DOS:  cpu time    0.0031: real time    0.0031
    --------------------------------------------
      LOOP:  cpu time  134.4236: real time  134.7315

 eigenvalue-minimisations  : 24584
 total energy-change (2. order) : 0.4154621E+03  (-0.2017549E+04)
 number of electron      51.0000005 magnetization       0.0016946      0.0167322      0.0001207
 augmentation part       51.0000005 magnetization       0.0016946      0.0167322      0.0001207

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        56.77422639
  Ewald energy   TEWEN  =     28503.46317635
  -Hartree energ DENC   =    -32333.44092563
  -exchange      EXHF   =         0.00000000
  -V(xc)+E(xc)   XCENC  =       146.70048897
  PAW double counting   =      5932.36931677    -5924.49054493
  entropy T*S    EENTRO =        -0.00517982
  eigenvalues    EBANDS =      -323.86867016
  atomic energy  EATOM  =      4357.96016915
  Solvation  Ediel_sol  =         0.00000000
  ---------------------------------------------------
  free energy    TOTEN  =       415.46205710 eV

  energy without entropy =      415.46723693  energy(sigma->0) =      415.46464702


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




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


     EDDAV:  cpu time  116.8438: real time  117.0717
       DOS:  cpu time    0.0025: real time    0.0025
    --------------------------------------------
      LOOP:  cpu time  116.8463: real time  117.0742

 eigenvalue-minimisations  : 26736
 total energy-change (2. order) :-0.3797939E+03  (-0.3629624E+03)
 number of electron      51.0000005 magnetization       0.0016946      0.0167322      0.0001207
 augmentation part       51.0000005 magnetization       0.0016946      0.0167322      0.0001207

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        56.77422639
  Ewald energy   TEWEN  =     28503.46317635
  -Hartree energ DENC   =    -32333.44092563
  -exchange      EXHF   =         0.00000000
  -V(xc)+E(xc)   XCENC  =       146.70048897
  PAW double counting   =      5932.36931677    -5924.49054493
  entropy T*S    EENTRO =        -0.00380484
  eigenvalues    EBANDS =      -703.66396320
  atomic energy  EATOM  =      4357.96016915
  Solvation  Ediel_sol  =         0.00000000
  ---------------------------------------------------
  free energy    TOTEN  =        35.66813904 eV

  energy without entropy =       35.67194389  energy(sigma->0) =       35.67004146


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




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


     EDDAV:  cpu time  102.0898: real time  102.2482
       DOS:  cpu time    0.0017: real time    0.0017
    --------------------------------------------
      LOOP:  cpu time  102.0915: real time  102.2499

 eigenvalue-minimisations  : 30496
 total energy-change (2. order) :-0.5798695E+02  (-0.5678319E+02)
 number of electron      51.0000005 magnetization       0.0016946      0.0167322      0.0001207
 augmentation part       51.0000005 magnetization       0.0016946      0.0167322      0.0001207

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        56.77422639
  Ewald energy   TEWEN  =     28503.46317635
  -Hartree energ DENC   =    -32333.44092563
  -exchange      EXHF   =         0.00000000
  -V(xc)+E(xc)   XCENC  =       146.70048897
  PAW double counting   =      5932.36931677    -5924.49054493
  entropy T*S    EENTRO =        -0.00202401
  eigenvalues    EBANDS =      -761.65269862
  atomic energy  EATOM  =      4357.96016915
  Solvation  Ediel_sol  =         0.00000000
  ---------------------------------------------------
  free energy    TOTEN  =       -22.31881555 eV

  energy without entropy =      -22.31679154  energy(sigma->0) =      -22.31780354


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




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


     EDDAV:  cpu time   84.7755: real time   84.8988
       DOS:  cpu time    0.0011: real time    0.0011
    --------------------------------------------
      LOOP:  cpu time   84.7767: real time   84.8999

 eigenvalue-minimisations  : 27704
 total energy-change (2. order) :-0.3264950E+01  (-0.3234446E+01)
 number of electron      51.0000005 magnetization       0.0016946      0.0167322      0.0001207
 augmentation part       51.0000005 magnetization       0.0016946      0.0167322      0.0001207

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        56.77422639
  Ewald energy   TEWEN  =     28503.46317635
  -Hartree energ DENC   =    -32333.44092563
  -exchange      EXHF   =         0.00000000
  -V(xc)+E(xc)   XCENC  =       146.70048897
  PAW double counting   =      5932.36931677    -5924.49054493
  entropy T*S    EENTRO =        -0.00187824
  eigenvalues    EBANDS =      -764.91779424
  atomic energy  EATOM  =      4357.96016915
  Solvation  Ediel_sol  =         0.00000000
  ---------------------------------------------------
  free energy    TOTEN  =       -25.58376539 eV

  energy without entropy =      -25.58188715  energy(sigma->0) =      -25.58282627


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




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


     EDDAV:  cpu time  117.3509: real time  117.5184
       DOS:  cpu time    0.0013: real time    0.0013
 


 total charge     
 
# of ion       s       p       d       tot
------------------------------------------
    1        1.184   0.838  10.048  12.070
    2        1.478   2.302   0.024   3.805
    3        1.454   2.388   0.019   3.861
    4        1.255   2.307   0.000   3.562
    5        2.021   5.801   0.236   8.057
    6        2.038   5.773   0.300   8.111
--------------------------------------------------
tot          9.430  19.410  10.626  39.466
 


 magnetization (x)
 
# of ion       s       p       d       tot
------------------------------------------
    1       -0.000  -0.002  -0.000  -0.002
    2        0.000  -0.005  -0.000  -0.005
    3       -0.000   0.002  -0.000   0.001
    4       -0.000   0.001   0.000   0.001
    5        0.000   0.000   0.000   0.000
    6       -0.000  -0.001   0.000  -0.001
--------------------------------------------------
tot         -0.000  -0.005  -0.000  -0.005
 


 magnetization (y)
 
# of ion       s       p       d       tot
------------------------------------------
    1       -0.002   0.001   0.000  -0.001
    2       -0.000   0.003   0.000   0.003
    3        0.000  -0.003  -0.000  -0.003
    4        0.000   0.000   0.000   0.000
    5       -0.000  -0.000   0.000  -0.000
    6        0.000   0.001   0.000   0.001
--------------------------------------------------
tot         -0.002   0.001   0.000  -0.000
 


 magnetization (z)
 
# of ion       s       p       d       tot
------------------------------------------
    1        0.000  -0.002  -0.000  -0.002
    2        0.000  -0.003  -0.000  -0.003
    3       -0.000   0.002  -0.000   0.002
    4        0.000   0.001   0.000   0.001
    5       -0.000  -0.000   0.000   0.000
    6       -0.000   0.001  -0.000   0.001
--------------------------------------------------
tot         -0.000  -0.001  -0.000  -0.001
 
    --------------------------------------------
      LOOP:  cpu time  117.3617: real time  117.5293

 eigenvalue-minimisations  : 40856
 total energy-change (2. order) :-0.3015457E+00  (-0.3008512E+00)
 number of electron      51.0000005 magnetization       0.0016946      0.0167322      0.0001207
 augmentation part       51.0000005 magnetization       0.0016946      0.0167322      0.0001207

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        56.77422639
  Ewald energy   TEWEN  =     28503.46317635
  -Hartree energ DENC   =    -32333.44092563
  -exchange      EXHF   =         0.00000000
  -V(xc)+E(xc)   XCENC  =       146.70048897
  PAW double counting   =      5932.36931677    -5924.49054493
  entropy T*S    EENTRO =        -0.00178622
  eigenvalues    EBANDS =      -765.21943195
  atomic energy  EATOM  =      4357.96016915
  Solvation  Ediel_sol  =         0.00000000
  ---------------------------------------------------
  free energy    TOTEN  =       -25.88531109 eV

  energy without entropy =      -25.88352487  energy(sigma->0) =      -25.88441798


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




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


     EDDAV:  cpu time  101.5380: real time  101.6912
       DOS:  cpu time    0.0011: real time    0.0011
    --------------------------------------------
      LOOP:  cpu time  101.5296: real time  101.6827

 eigenvalue-minimisations  : 32448
 total energy-change (2. order) :-0.6188704E-02  (-0.6186760E-02)
 number of electron      51.0000005 magnetization       0.0016946      0.0167322      0.0001207
 augmentation part       51.0000005 magnetization       0.0016946      0.0167322      0.0001207

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        56.77422639
  Ewald energy   TEWEN  =     28503.46317635
  -Hartree energ DENC   =    -32333.44092563
  -exchange      EXHF   =         0.00000000
  -V(xc)+E(xc)   XCENC  =       146.70048897
  PAW double counting   =      5932.36931677    -5924.49054493
  entropy T*S    EENTRO =        -0.00178683
  eigenvalues    EBANDS =      -765.22562005
  atomic energy  EATOM  =      4357.96016915
  Solvation  Ediel_sol  =         0.00000000
  ---------------------------------------------------
  free energy    TOTEN  =       -25.89149980 eV

  energy without entropy =      -25.88971297  energy(sigma->0) =      -25.89060638


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




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


     EDDAV:  cpu time   95.8201: real time   95.9269
       DOS:  cpu time    0.0011: real time    0.0011
    --------------------------------------------
      LOOP:  cpu time   95.8212: real time   95.9280

 eigenvalue-minimisations  : 37560
 total energy-change (2. order) :-0.3744037E-03  (-0.3743580E-03)
 number of electron      51.0000005 magnetization       0.0016946      0.0167322      0.0001207
 augmentation part       51.0000005 magnetization       0.0016946      0.0167322      0.0001207

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        56.77422639
  Ewald energy   TEWEN  =     28503.46317635
  -Hartree energ DENC   =    -32333.44092563
  -exchange      EXHF   =         0.00000000
  -V(xc)+E(xc)   XCENC  =       146.70048897
  PAW double counting   =      5932.36931677    -5924.49054493
  entropy T*S    EENTRO =        -0.00178699
  eigenvalues    EBANDS =      -765.22599429
  atomic energy  EATOM  =      4357.96016915
  Solvation  Ediel_sol  =         0.00000000
  ---------------------------------------------------
  free energy    TOTEN  =       -25.89187420 eV

  energy without entropy =      -25.89008721  energy(sigma->0) =      -25.89098071


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




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


     EDDAV:  cpu time   85.6132: real time   85.7134
       DOS:  cpu time    0.0022: real time    0.0022
    --------------------------------------------
      LOOP:  cpu time   85.6154: real time   85.7156

 eigenvalue-minimisations  : 32920
 total energy-change (2. order) :-0.2367845E-04  (-0.2367616E-04)
 number of electron      51.0000005 magnetization       0.0016946      0.0167322      0.0001207
 augmentation part       51.0000005 magnetization       0.0016946      0.0167322      0.0001207

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        56.77422639
  Ewald energy   TEWEN  =     28503.46317635
  -Hartree energ DENC   =    -32333.44092563
  -exchange      EXHF   =         0.00000000
  -V(xc)+E(xc)   XCENC  =       146.70048897
  PAW double counting   =      5932.36931677    -5924.49054493
  entropy T*S    EENTRO =        -0.00178699
  eigenvalues    EBANDS =      -765.22601797
  atomic energy  EATOM  =      4357.96016915
  Solvation  Ediel_sol  =         0.00000000
  ---------------------------------------------------
  free energy    TOTEN  =       -25.89189788 eV

  energy without entropy =      -25.89011089  energy(sigma->0) =      -25.89100438


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




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


     EDDAV:  cpu time   71.9230: real time   71.9996
       DOS:  cpu time    0.0021: real time    0.0021
    --------------------------------------------
      LOOP:  cpu time   71.9251: real time   72.0017

 eigenvalue-minimisations  : 26488
 total energy-change (2. order) :-0.1855527E-05  (-0.1854705E-05)
 number of electron      51.0000005 magnetization       0.0016946      0.0167322      0.0001207
 augmentation part       51.0000005 magnetization       0.0016946      0.0167322      0.0001207

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        56.77422639
  Ewald energy   TEWEN  =     28503.46317635
  -Hartree energ DENC   =    -32333.44092563
  -exchange      EXHF   =         0.00000000
  -V(xc)+E(xc)   XCENC  =       146.70048897
  PAW double counting   =      5932.36931677    -5924.49054493
  entropy T*S    EENTRO =        -0.00178699
  eigenvalues    EBANDS =      -765.22601982
  atomic energy  EATOM  =      4357.96016915
  Solvation  Ediel_sol  =         0.00000000
  ---------------------------------------------------
  free energy    TOTEN  =       -25.89189973 eV

  energy without entropy =      -25.89011274  energy(sigma->0) =      -25.89100624


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




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


     EDDAV:  cpu time   56.4915: real time   56.5359
       DOS:  cpu time    0.0021: real time    0.0021
 


 total charge     
 
# of ion       s       p       d       tot
------------------------------------------
    1        1.184   0.839  10.048  12.070
    2        1.478   2.303   0.024   3.805
    3        1.454   2.388   0.019   3.861
    4        1.255   2.307   0.000   3.562
    5        2.023   5.801   0.235   8.059
    6        2.041   5.773   0.299   8.113
--------------------------------------------------
tot          9.435  19.410  10.624  39.469
 


 magnetization (x)
 
# of ion       s       p       d       tot
------------------------------------------
    1       -0.000  -0.002  -0.000  -0.002
    2        0.000  -0.005  -0.000  -0.005
    3       -0.000   0.002  -0.000   0.001
    4       -0.000   0.001   0.000   0.001
    5        0.000   0.000   0.000   0.000
    6       -0.000  -0.001   0.000  -0.001
--------------------------------------------------
tot         -0.000  -0.005  -0.000  -0.005
 


 magnetization (y)
 
# of ion       s       p       d       tot
------------------------------------------
    1       -0.002   0.001   0.000  -0.001
    2       -0.000   0.003   0.000   0.003
    3        0.000  -0.003  -0.000  -0.003
    4        0.000   0.000   0.000   0.000
    5       -0.000  -0.000   0.000  -0.000
    6        0.000   0.001   0.000   0.001
--------------------------------------------------
tot         -0.002   0.001   0.000  -0.000
 


 magnetization (z)
 
# of ion       s       p       d       tot
------------------------------------------
    1        0.000  -0.002  -0.000  -0.002
    2        0.000  -0.003  -0.000  -0.003
    3       -0.000   0.002  -0.000   0.002
    4        0.000   0.000   0.000   0.001
    5       -0.000  -0.000   0.000   0.000
    6       -0.000   0.001  -0.000   0.001
--------------------------------------------------
tot         -0.000  -0.001  -0.000  -0.001
 
    --------------------------------------------
      LOOP:  cpu time   56.5399: real time   56.5844

 eigenvalue-minimisations  : 20504
 total energy-change (2. order) :-0.1536546E-06  (-0.1530080E-06)
 number of electron      51.0000005 magnetization       0.0016946      0.0167322      0.0001207
 augmentation part       51.0000005 magnetization       0.0016946      0.0167322      0.0001207

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        56.77422639
  Ewald energy   TEWEN  =     28503.46317635
  -Hartree energ DENC   =    -32333.44092563
  -exchange      EXHF   =         0.00000000
  -V(xc)+E(xc)   XCENC  =       146.70048897
  PAW double counting   =      5932.36931677    -5924.49054493
  entropy T*S    EENTRO =        -0.00178699
  eigenvalues    EBANDS =      -765.22601998
  atomic energy  EATOM  =      4357.96016915
  Solvation  Ediel_sol  =         0.00000000
  ---------------------------------------------------
  free energy    TOTEN  =       -25.89189989 eV

  energy without entropy =      -25.89011290  energy(sigma->0) =      -25.89100639


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




 average (electrostatic) potential at core
  the test charge radii are     1.0894  1.0808  0.7089  1.1929
  (the norm of the test charge is              1.0000)
       1-108.9424       2 -59.9654       3 -59.7702       4 -68.4892       5 -42.2037
       6 -42.2921
 
 
 
 E-fermi :  -1.5887     XC(G=0):  -3.0424     alpha+bet : -2.9160


 k-point     1 :       0.0000    0.0000    0.0000
  band No.  band energies     occupation 
      1     -36.4147      1.00000
      2     -36.4134      1.00000
      3     -36.2779      1.00000
      4     -36.2776      1.00000
      5     -23.9363      1.00000
      6     -23.9363      1.00000
      7     -23.9289      1.00000
      8     -23.9288      1.00000
      9     -22.9112      1.00000
     10     -22.9112      1.00000
     11     -22.8934      1.00000
     12     -22.8934      1.00000
     13     -22.8902      1.00000
     14     -22.8902      1.00000
     15     -19.3414      1.00000
     16     -19.3405      1.00000
     17     -18.9932      1.00000
     18     -18.9930      1.00000
     19     -18.2993      1.00000
     20     -18.2987      1.00000
     21     -17.9261      1.00000
     22     -17.9260      1.00000
     23     -17.9116      1.00000
     24     -17.9111      1.00000
     25     -17.8140      1.00000
     26     -17.8140      1.00000
     27     -15.5270      1.00000
     28     -15.5268      1.00000
     29     -14.5456      1.00000
     30     -14.5454      1.00000
     31     -13.0188      1.00000
     32     -13.0170      1.00000
     33      -8.2957      1.00000
     34      -8.2955      1.00000
     35      -4.4735      1.00000
     36      -4.4727      1.00000
     37      -3.5636      1.00000
     38      -3.5594      1.00000
     39      -3.2737      1.00000
     40      -3.2726      1.00000
     41      -3.0771      1.00000
     42      -3.0770      1.00000
     43      -3.0768      1.00000
     44      -3.0767      1.00000
     45      -2.8502      1.00000
     46      -2.8500      1.00000
     47      -2.6742      1.00000
     48      -2.6740      1.00000
     49      -2.5723      1.00000
     50      -2.5721      1.00000
     51      -2.0525      1.00000
     52      -2.0223      1.00000
     53      -1.4599      0.00014
     54      -1.4499      0.00004
     55       0.1122      0.00000
     56       0.1135      0.00000
     57       0.6872      0.00000
     58       0.7082      0.00000
     59       1.4712      0.00000
     60       1.4714      0.00000
     61       1.5447      0.00000
     62       1.5585      0.00000
     63       1.7608      0.00000
     64       1.7609      0.00000
     65       1.9254      0.00000
     66       1.9312      0.00000
     67       2.2728      0.00000
     68       2.2782      0.00000
     69       2.3084      0.00000
     70       2.3131      0.00000
     71       2.3920      0.00000
     72       2.4123      0.00000

 k-point     2 :       0.0102    0.0000    0.0000
  band No.  band energies     occupation 
      1     -36.4147      1.00000
      2     -36.4134      1.00000
      3     -36.2779      1.00000
      4     -36.2776      1.00000
      5     -23.9363      1.00000
      6     -23.9363      1.00000
      7     -23.9289      1.00000
      8     -23.9288      1.00000
      9     -22.9113      1.00000
     10     -22.9111      1.00000
     11     -22.8934      1.00000
     12     -22.8934      1.00000
     13     -22.8902      1.00000
     14     -22.8902      1.00000
     15     -19.3422      1.00000
     16     -19.3396      1.00000
     17     -18.9935      1.00000
     18     -18.9931      1.00000
     19     -18.3012      1.00000
     20     -18.2969      1.00000
     21     -17.9274      1.00000
     22     -17.9272      1.00000
     23     -17.9118      1.00000
     24     -17.9092      1.00000
     25     -17.8143      1.00000
     26     -17.8143      1.00000
     27     -15.5264      1.00000
     28     -15.5257      1.00000
     29     -14.5455      1.00000
     30     -14.5444      1.00000
     31     -13.0181      1.00000
     32     -13.0172      1.00000
     33      -8.2959      1.00000
     34      -8.2955      1.00000
     35      -4.4766      1.00000
     36      -4.4686      1.00000
     37      -3.5683      1.00000
     38      -3.5573      1.00000
     39      -3.2823      1.00000
     40      -3.2720      1.00000
     41      -3.1046      1.00000
     42      -3.0999      1.00000
     43      -3.0598      1.00000
     44      -3.0553      1.00000
     45      -2.8541      1.00000
     46      -2.8537      1.00000
     47      -2.6762      1.00000
     48      -2.6755      1.00000
     49      -2.5758      1.00000
     50      -2.5756      1.00000
     51      -2.0500      1.00000
     52      -2.0133      1.00000
     53      -1.4582      0.00011
     54      -1.4420      0.00002
     55       0.1184      0.00000
     56       0.1220      0.00000
     57       0.6897      0.00000
     58       0.7078      0.00000
     59       1.4669      0.00000
     60       1.4720      0.00000
     61       1.5495      0.00000
     62       1.5580      0.00000
     63       1.7586      0.00000
     64       1.7588      0.00000
     65       1.9206      0.00000
     66       1.9323      0.00000
     67       2.2620      0.00000
     68       2.2791      0.00000
     69       2.3091      0.00000
     70       2.3197      0.00000
     71       2.3940      0.00000
     72       2.3952      0.00000

 k-point     3 :       0.0204    0.0000    0.0000
  band No.  band energies     occupation 
      1     -36.4145      1.00000
      2     -36.4133      1.00000
      3     -36.2778      1.00000
      4     -36.2775      1.00000
      5     -23.9363      1.00000
      6     -23.9363      1.00000
      7     -23.9290      1.00000
      8     -23.9287      1.00000
      9     -22.9113      1.00000
     10     -22.9110      1.00000
     11     -22.8935      1.00000
     12     -22.8935      1.00000
     13     -22.8902      1.00000
     14     -22.8901      1.00000
     15     -19.3437      1.00000
     16     -19.3380      1.00000
     17     -18.9945      1.00000
     18     -18.9935      1.00000
     19     -18.3033      1.00000
     20     -18.2952      1.00000
     21     -17.9307      1.00000
     22     -17.9302      1.00000
     23     -17.9107      1.00000
     24     -17.9064      1.00000
     25     -17.8152      1.00000
     26     -17.8151      1.00000
     27     -15.5243      1.00000
     28     -15.5229      1.00000
     29     -14.5443      1.00000
     30     -14.5421      1.00000
     31     -13.0174      1.00000
     32     -13.0161      1.00000
     33      -8.2963      1.00000
     34      -8.2956      1.00000
     35      -4.4790      1.00000
     36      -4.4635      1.00000
     37      -3.5793      1.00000
     38      -3.5538      1.00000
     39      -3.2989      1.00000
     40      -3.2806      1.00000
     41      -3.1383      1.00000
     42      -3.1292      1.00000
     43      -3.0481      1.00000
     44      -3.0398      1.00000
     45      -2.8655      1.00000
     46      -2.8629      1.00000
     47      -2.6828      1.00000
     48      -2.6812      1.00000
     49      -2.5849      1.00000
     50      -2.5847      1.00000
     51      -2.0370      1.00000
     52      -1.9939      1.00000
     53      -1.4468      0.00003
     54      -1.4246      0.00000
     55       0.1379      0.00000
     56       0.1459      0.00000
     57       0.6942      0.00000
     58       0.7097      0.00000
     59       1.4596      0.00000
     60       1.4691      0.00000
     61       1.5543      0.00000
     62       1.5646      0.00000
     63       1.7516      0.00000
     64       1.7535      0.00000
     65       1.9124      0.00000
     66       1.9296      0.00000
     67       2.2513      0.00000
     68       2.2701      0.00000
     69       2.3234      0.00000
     70       2.3338      0.00000
     71       2.4005      0.00000
     72       2.4029      0.00000

 k-point     4 :       0.0306    0.0000    0.0000
  band No.  band energies     occupation 
      1     -36.4143      1.00000
      2     -36.4131      1.00000
      3     -36.2777      1.00000
      4     -36.2774      1.00000
      5     -23.9363      1.00000
      6     -23.9363      1.00000
      7     -23.9290      1.00000
      8     -23.9287      1.00000
      9     -22.9114      1.00000
     10     -22.9109      1.00000
     11     -22.8936      1.00000
     12     -22.8935      1.00000
     13     -22.8902      1.00000
     14     -22.8901      1.00000
     15     -19.3452      1.00000
     16     -19.3362      1.00000
     17     -18.9959      1.00000
     18     -18.9943      1.00000
     19     -18.3056      1.00000
     20     -18.2935      1.00000
     21     -17.9353      1.00000
     22     -17.9343      1.00000
     23     -17.9094      1.00000
     24     -17.9032      1.00000
     25     -17.8168      1.00000
     26     -17.8166      1.00000
     27     -15.5204      1.00000
     28     -15.5185      1.00000
     29     -14.5420      1.00000
     30     -14.5388      1.00000
     31     -13.0165      1.00000
     32     -13.0142      1.00000
     33      -8.2969      1.00000
     34      -8.2959      1.00000
     35      -4.4806      1.00000
     36      -4.4574      1.00000
     37      -3.5940      1.00000
     38      -3.5523      1.00000
     39      -3.3241      1.00000
     40      -3.3003      1.00000
     41      -3.1760      1.00000
     42      -3.1649      1.00000
     43      -3.0414      1.00000
     44      -3.0308      1.00000
     45      -2.8817      1.00000
     46      -2.8745      1.00000
     47      -2.6960      1.00000
     48      -2.6930      1.00000
     49      -2.5958      1.00000
     50      -2.5954      1.00000
     51      -2.0153      1.00000
     52      -1.9670      1.00000
     53      -1.4264      0.00000
     54      -1.3987      0.00000
     55       0.1709      0.00000
     56       0.1830      0.00000
     57       0.7004      0.00000
     58       0.7140      0.00000
     59       1.4497      0.00000
     60       1.4625      0.00000
     61       1.5598      0.00000
     62       1.5763      0.00000
     63       1.7402      0.00000
     64       1.7464      0.00000
     65       1.9024      0.00000
     66       1.9234      0.00000
     67       2.2441      0.00000
     68       2.2620      0.00000
     69       2.3381      0.00000
     70       2.3474      0.00000
     71       2.4113      0.00000
     72       2.4163      0.00000

 k-point     5 :       0.0408    0.0000    0.0000
  band No.  band energies     occupation 
      1     -36.4140      1.00000
      2     -36.4128      1.00000
      3     -36.2776      1.00000
      4     -36.2773      1.00000
      5     -23.9362      1.00000
      6     -23.9362      1.00000
      7     -23.9291      1.00000
      8     -23.9287      1.00000
      9     -22.9114      1.00000
     10     -22.9108      1.00000
     11     -22.8937      1.00000
     12     -22.8937      1.00000
     13     -22.8901      1.00000
     14     -22.8900      1.00000
     15     -19.3467      1.00000
     16     -19.3345      1.00000
     17     -18.9977      1.00000
     18     -18.9956      1.00000
     19     -18.3080      1.00000
     20     -18.2920      1.00000
     21     -17.9405      1.00000
     22     -17.9391      1.00000
     23     -17.9082      1.00000
     24     -17.9001      1.00000
     25     -17.8190      1.00000
     26     -17.8184      1.00000
     27     -15.5149      1.00000
     28     -15.5124      1.00000
     29     -14.5386      1.00000
     30     -14.5344      1.00000
     31     -13.0150      1.00000
     32     -13.0116      1.00000
     33      -8.2977      1.00000
     34      -8.2964      1.00000
     35      -4.4820      1.00000
     36      -4.4503      1.00000
     37      -3.6134      1.00000
     38      -3.5529      1.00000
     39      -3.3593      1.00000
     40      -3.3335      1.00000
     41      -3.2141      1.00000
     42      -3.2053      1.00000
     43      -3.0403      1.00000
     44      -3.0300      1.00000
     45      -2.8985      1.00000
     46      -2.8861      1.00000
     47      -2.7170      1.00000
     48      -2.7122      1.00000
     49      -2.6047      1.00000
     50      -2.6042      1.00000
     51      -1.9877      1.00000
     52      -1.9355      1.00000
     53      -1.3979      0.00000
     54      -1.3654      0.00000
     55       0.2157      0.00000
     56       0.2318      0.00000
     57       0.7081      0.00000
     58       0.7207      0.00000
     59       1.4373      0.00000
     60       1.4529      0.00000
     61       1.5664      0.00000
     62       1.5900      0.00000
     63       1.7252      0.00000
     64       1.7390      0.00000
     65       1.8924      0.00000
     66       1.9149      0.00000
     67       2.2414      0.00000
     68       2.2583      0.00000
     69       2.3555      0.00000
     70       2.3756      0.00000
     71       2.4259      0.00000
     72       2.4399      0.00000

 k-point     6 :       0.0510    0.0000    0.0000
  band No.  band energies     occupation 
      1     -36.4136      1.00000
      2     -36.4124      1.00000
      3     -36.2774      1.00000
      4     -36.2771      1.00000
      5     -23.9362      1.00000
      6     -23.9362      1.00000
      7     -23.9292      1.00000
      8     -23.9286      1.00000
      9     -22.9115      1.00000
     10     -22.9106      1.00000
     11     -22.8938      1.00000
     12     -22.8938      1.00000
     13     -22.8900      1.00000
     14     -22.8899      1.00000
     15     -19.3481      1.00000
     16     -19.3327      1.00000
     17     -18.9999      1.00000
     18     -18.9974      1.00000
     19     -18.3104      1.00000
     20     -18.2907      1.00000
     21     -17.9462      1.00000
     22     -17.9446      1.00000
     23     -17.9074      1.00000
     24     -17.8971      1.00000
     25     -17.8218      1.00000
     26     -17.8207      1.00000
     27     -15.5078      1.00000
     28     -15.5046      1.00000
     29     -14.5341      1.00000
     30     -14.5288      1.00000
     31     -13.0130      1.00000
     32     -13.0084      1.00000
     33      -8.2988      1.00000
     34      -8.2973      1.00000
     35      -4.4833      1.00000
     36      -4.4425      1.00000
     37      -3.6395      1.00000
     38      -3.5559      1.00000
     39      -3.4060      1.00000
     40      -3.3794      1.00000
     41      -3.2496      1.00000
     42      -3.2475      1.00000
     43      -3.0461      1.00000
     44      -3.0401      1.00000
     45      -2.9118      1.00000
     46      -2.8964      1.00000
     47      -2.7436      1.00000
     48      -2.7374      1.00000
     49      -2.6101      1.00000
     50      -2.6094      1.00000
     51      -1.9565      1.00000
     52      -1.9016      1.00000
     53      -1.3627      0.00000
     54      -1.3262      0.00000
     55       0.2703      0.00000
     56       0.2901      0.00000
     57       0.7172      0.00000
     58       0.7301      0.00000
     59       1.4227      0.00000
     60       1.4412      0.00000
     61       1.5720      0.00000
     62       1.6031      0.00000
     63       1.7090      0.00000
     64       1.7332      0.00000
     65       1.8847      0.00000
     66       1.9062      0.00000
     67       2.2430      0.00000
     68       2.2574      0.00000
     69       2.3678      0.00000
     70       2.3730      0.00000
     71       2.4422      0.00000
     72       2.4542      0.00000

 k-point     7 :       0.0612    0.0000    0.0000
  band No.  band energies     occupation 
      1     -36.4132      1.00000
      2     -36.4119      1.00000
      3     -36.2772      1.00000
      4     -36.2769      1.00000
      5     -23.9361      1.00000
      6     -23.9361      1.00000
      7     -23.9293      1.00000
      8     -23.9286      1.00000
      9     -22.9115      1.00000
     10     -22.9105      1.00000
     11     -22.8940      1.00000
     12     -22.8939      1.00000
     13     -22.8899      1.00000
     14     -22.8897      1.00000
     15     -19.3495      1.00000
     16     -19.3308      1.00000
     17     -19.0026      1.00000
     18     -18.9996      1.00000
     19     -18.3130      1.00000
     20     -18.2894      1.00000
     21     -17.9523      1.00000
     22     -17.9506      1.00000
     23     -17.9072      1.00000
     24     -17.8943      1.00000
     25     -17.8252      1.00000
     26     -17.8233      1.00000
     27     -15.4991      1.00000
     28     -15.4953      1.00000
     29     -14.5285      1.00000
     30     -14.5223      1.00000
     31     -13.0105      1.00000
     32     -13.0047      1.00000
     33      -8.3002      1.00000
     34      -8.2984      1.00000
     35      -4.4851      1.00000
     36      -4.4342      1.00000
     37      -3.6756      1.00000
     38      -3.5625      1.00000
     39      -3.4638      1.00000
     40      -3.4326      1.00000
     41      -3.2888      1.00000
     42      -3.2828      1.00000
     43      -3.0629      1.00000
     44      -3.0610      1.00000
     45      -2.9194      1.00000
     46      -2.9047      1.00000
     47      -2.7713      1.00000
     48      -2.7646      1.00000
     49      -2.6127      1.00000
     50      -2.6118      1.00000
     51      -1.9235      1.00000
     52      -1.8669      1.00000
     53      -1.3227      0.00000
     54      -1.2829      0.00000
     55       0.3320      0.00000
     56       0.3553      0.00000
     57       0.7277      0.00000
     58       0.7422      0.00000
     59       1.4065      0.00000
     60       1.4288      0.00000
     61       1.5731      0.00000
     62       1.6088      0.00000
     63       1.6981      0.00000
     64       1.7312      0.00000
     65       1.8816      0.00000
     66       1.9001      0.00000
     67       2.2494      0.00000
     68       2.2619      0.00000
     69       2.3825      0.00000
     70       2.3846      0.00000
     71       2.4605      0.00000
     72       2.4699      0.00000

 k-point     8 :       0.0714    0.0000    0.0000
  band No.  band energies     occupation 
      1     -36.4126      1.00000
      2     -36.4114      1.00000
      3     -36.2769      1.00000
      4     -36.2766      1.00000
      5     -23.9361      1.00000
      6     -23.9360      1.00000
      7     -23.9294      1.00000
      8     -23.9286      1.00000
      9     -22.9115      1.00000
     10     -22.9103      1.00000
     11     -22.8942      1.00000
     12     -22.8941      1.00000
     13     -22.8897      1.00000
     14     -22.8896      1.00000
     15     -19.3508      1.00000
     16     -19.3290      1.00000
     17     -19.0056      1.00000
     18     -19.0023      1.00000
     19     -18.3157      1.00000
     20     -18.2883      1.00000
     21     -17.9587      1.00000
     22     -17.9571      1.00000
     23     -17.9075      1.00000
     24     -17.8919      1.00000
     25     -17.8291      1.00000
     26     -17.8261      1.00000
     27     -15.4887      1.00000
     28     -15.4843      1.00000
     29     -14.5218      1.00000
     30     -14.5147      1.00000
     31     -13.0074      1.00000
     32     -13.0006      1.00000
     33      -8.3020      1.00000
     34      -8.2999      1.00000
     35      -4.4880      1.00000
     36      -4.4258      1.00000
     37      -3.7250      1.00000
     38      -3.5792      1.00000
     39      -3.5248      1.00000
     40      -3.4853      1.00000
     41      -3.3281      1.00000
     42      -3.3150      1.00000
     43      -3.0975      1.00000
     44      -3.0869      1.00000
     45      -2.9225      1.00000
     46      -2.9108      1.00000
     47      -2.7953      1.00000
     48      -2.7904      1.00000
     49      -2.6138      1.00000
     50      -2.6126      1.00000
     51      -1.8897      1.00000
     52      -1.8320      1.00000
     53      -1.2798      0.00000
     54      -1.2374      0.00000
     55       0.3974      0.00000
     56       0.4244      0.00000
     57       0.7406      0.00000
     58       0.7571      0.00000
     59       1.3902      0.00000
     60       1.4174      0.00000
     61       1.5658      0.00000
     62       1.5974      0.00000
     63       1.7029      0.00000
     64       1.7360      0.00000
     65       1.8846      0.00000
     66       1.8995      0.00000
     67       2.2599      0.00000
     68       2.2709      0.00000
     69       2.3956      0.00000
     70       2.3985      0.00000
     71       2.4765      0.00000
     72       2.4838      0.00000

 k-point     9 :       0.0816    0.0000    0.0000
  band No.  band energies     occupation 
      1     -36.4120      1.00000
      2     -36.4107      1.00000
      3     -36.2766      1.00000
      4     -36.2763      1.00000
      5     -23.9360      1.00000
      6     -23.9360      1.00000
      7     -23.9295      1.00000
      8     -23.9286      1.00000
      9     -22.9115      1.00000
     10     -22.9102      1.00000
     11     -22.8944      1.00000
     12     -22.8943      1.00000
     13     -22.8896      1.00000
     14     -22.8894      1.00000
     15     -19.3521      1.00000
     16     -19.3271      1.00000
     17     -19.0090      1.00000
     18     -19.0055      1.00000
     19     -18.3185      1.00000
     20     -18.2872      1.00000
     21     -17.9655      1.00000
     22     -17.9640      1.00000
     23     -17.9085      1.00000
     24     -17.8898      1.00000
     25     -17.8335      1.00000
     26     -17.8290      1.00000
     27     -15.4767      1.00000
     28     -15.4718      1.00000
     29     -14.5141      1.00000
     30     -14.5061      1.00000
     31     -13.0039      1.00000
     32     -12.9959      1.00000
     33      -8.3042      1.00000
     34      -8.3019      1.00000
     35      -4.4931      1.00000
     36      -4.4178      1.00000
     37      -3.7893      1.00000
     38      -3.6326      1.00000
     39      -3.5595      1.00000
     40      -3.5333      1.00000
     41      -3.3656      1.00000
     42      -3.3470      1.00000
     43      -3.1414      1.00000
     44      -3.1238      1.00000
     45      -2.9233      1.00000
     46      -2.9149      1.00000
     47      -2.8135      1.00000
     48      -2.8121      1.00000
     49      -2.6140      1.00000
     50      -2.6124      1.00000
     51      -1.8554      1.00000
     52      -1.7972      1.00000
     53      -1.2360      0.00000
     54      -1.1919      0.00000
     55       0.4621      0.00000
     56       0.4934      0.00000
     57       0.7575      0.00000
     58       0.7756      0.00000
     59       1.3750      0.00000
     60       1.4086      0.00000
     61       1.5486      0.00000
     62       1.5709      0.00000
     63       1.7228      0.00000
     64       1.7492      0.00000
     65       1.8944      0.00000
     66       1.9058      0.00000
     67       2.2743      0.00000
     68       2.2841      0.00000
     69       2.4126      0.00000
     70       2.4161      0.00000
     71       2.4941      0.00000
     72       2.5146      0.00000

 k-point    10 :       0.0918    0.0000    0.0000
  band No.  band energies     occupation 
      1     -36.4113      1.00000
      2     -36.4100      1.00000
      3     -36.2763      1.00000
      4     -36.2760      1.00000
      5     -23.9359      1.00000
      6     -23.9359      1.00000
      7     -23.9296      1.00000
      8     -23.9285      1.00000
      9     -22.9116      1.00000
     10     -22.9100      1.00000
     11     -22.8946      1.00000
     12     -22.8945      1.00000
     13     -22.8894      1.00000
     14     -22.8893      1.00000
     15     -19.3534      1.00000
     16     -19.3253      1.00000
     17     -19.0128      1.00000
     18     -19.0091      1.00000
     19     -18.3213      1.00000
     20     -18.2863      1.00000
     21     -17.9725      1.00000
     22     -17.9715      1.00000
     23     -17.9102      1.00000
     24     -17.8880      1.00000
     25     -17.8383      1.00000
     26     -17.8319      1.00000
     27     -15.4631      1.00000
     28     -15.4577      1.00000
     29     -14.5054      1.00000
     30     -14.4966      1.00000
     31     -12.9999      1.00000
     32     -12.9909      1.00000
     33      -8.3069      1.00000
     34      -8.3045      1.00000
     35      -4.5013      1.00000
     36      -4.4114      1.00000
     37      -3.8656      1.00000
     38      -3.7113      1.00000
     39      -3.5778      1.00000
     40      -3.5760      1.00000
     41      -3.4012      1.00000
     42      -3.3786      1.00000
     43      -3.1915      1.00000
     44      -3.1694      1.00000
     45      -2.9236      1.00000
     46      -2.9172      1.00000
     47      -2.8292      1.00000
     48      -2.8255      1.00000
     49      -2.6139      1.00000
     50      -2.6119      1.00000
     51      -1.8209      1.00000
     52      -1.7625      1.00000
     53      -1.1933      0.00000
     54      -1.1482      0.00000
     55       0.5207      0.00000
     56       0.5572      0.00000
     57       0.7812      0.00000
     58       0.7992      0.00000
     59       1.3618      0.00000
     60       1.4022      0.00000
     61       1.5249      0.00000
     62       1.5389      0.00000
     63       1.7510      0.00000
     64       1.7704      0.00000
     65       1.9108      0.00000
     66       1.9196      0.00000
     67       2.2923      0.00000
     68       2.3010      0.00000
     69       2.4298      0.00000
     70       2.4301      0.00000
     71       2.5110      0.00000
     72       2.5180      0.00000

 k-point    11 :       0.1020    0.0000    0.0000
  band No.  band energies     occupation 
      1     -36.4105      1.00000
      2     -36.4093      1.00000
      3     -36.2759      1.00000
      4     -36.2757      1.00000
      5     -23.9359      1.00000
      6     -23.9358      1.00000
      7     -23.9296      1.00000
      8     -23.9285      1.00000
      9     -22.9116      1.00000
     10     -22.9099      1.00000
     11     -22.8949      1.00000
     12     -22.8948      1.00000
     13     -22.8892      1.00000
     14     -22.8891      1.00000
     15     -19.3546      1.00000
     16     -19.3234      1.00000
     17     -19.0169      1.00000
     18     -19.0132      1.00000
     19     -18.3242      1.00000
     20     -18.2854      1.00000
     21     -17.9798      1.00000
     22     -17.9794      1.00000
     23     -17.9127      1.00000
     24     -17.8867      1.00000
     25     -17.8434      1.00000
     26     -17.8348      1.00000
     27     -15.4480      1.00000
     28     -15.4421      1.00000
     29     -14.4958      1.00000
     30     -14.4861      1.00000
     31     -12.9955      1.00000
     32     -12.9855      1.00000
     33      -8.3103      1.00000
     34      -8.3077      1.00000
     35      -4.5143      1.00000
     36      -4.4083      1.00000
     37      -3.9486      1.00000
     38      -3.7949      1.00000
     39      -3.6193      1.00000
     40      -3.5952      1.00000
     41      -3.4345      1.00000
     42      -3.4092      1.00000
     43      -3.2449      1.00000
     44      -3.2200      1.00000
     45      -2.9244      1.00000
     46      -2.9185      1.00000
     47      -2.8415      1.00000
     48      -2.8332      1.00000
     49      -2.6135      1.00000
     50      -2.6112      1.00000
     51      -1.7861      1.00000
     52      -1.7276      0.99996
     53      -1.1534      0.00000
     54      -1.1081      0.00000
     55       0.5674      0.00000
     56       0.6102      0.00000
     57       0.8148      0.00000
     58       0.8305      0.00000
     59       1.3487      0.00000
     60       1.3940      0.00000
     61       1.5040      0.00000
     62       1.5106      0.00000
     63       1.7843      0.00000
     64       1.7977      0.00000
     65       1.9335      0.00000
     66       1.9405      0.00000
     67       2.3134      0.00000
     68       2.3212      0.00000
     69       2.4479      0.00000
     70       2.4496      0.00000
     71       2.5283      0.00000
     72       2.5350      0.00000

 k-point    12 :       0.1122    0.0000    0.0000
  band No.  band energies     occupation 
      1     -36.4097      1.00000
      2     -36.4084      1.00000
      3     -36.2755      1.00000
      4     -36.2753      1.00000
      5     -23.9358      1.00000
      6     -23.9357      1.00000
      7     -23.9297      1.00000
      8     -23.9285      1.00000
      9     -22.9116      1.00000
     10     -22.9097      1.00000
     11     -22.8952      1.00000
     12     -22.8950      1.00000
     13     -22.8889      1.00000
     14     -22.8888      1.00000
     15     -19.3559      1.00000
     16     -19.3216      1.00000
     17     -19.0213      1.00000
     18     -19.0178      1.00000
     19     -18.3272      1.00000
     20     -18.2847      1.00000
     21     -17.9877      1.00000
     22     -17.9873      1.00000
     23     -17.9158      1.00000
     24     -17.8859      1.00000
     25     -17.8485      1.00000
     26     -17.8376      1.00000
     27     -15.4313      1.00000
     28     -15.4249      1.00000
     29     -14.4852      1.00000
     30     -14.4748      1.00000
     31     -12.9907      1.00000
     32     -12.9797      1.00000
     33      -8.3143      1.00000
     34      -8.3117      1.00000
     35      -4.5340      1.00000
     36      -4.4118      1.00000
     37      -4.0319      1.00000
     38      -3.8780      1.00000
     39      -3.6639      1.00000
     40      -3.6184      1.00000
     41      -3.4649      1.00000
     42      -3.4385      1.00000
     43      -3.2982      1.00000
     44      -3.2715      1.00000
     45      -2.9261      1.00000
     46      -2.9193      1.00000
     47      -2.8498      1.00000
     48      -2.8377      1.00000
     49      -2.6132      1.00000
     50      -2.6105      1.00000
     51      -1.7508      1.00000
     52      -1.6924      0.99833
     53      -1.1182      0.00000
     54      -1.0734      0.00000
     55       0.5998      0.00000
     56       0.6480      0.00000
     57       0.8586      0.00000
     58       0.8710      0.00000
     59       1.3297      0.00000
     60       1.3736      0.00000
     61       1.4955      0.00000
     62       1.5012      0.00000
     63       1.8211      0.00000
     64       1.8296      0.00000
     65       1.9619      0.00000
     66       1.9679      0.00000
     67       2.3372      0.00000
     68       2.3440      0.00000
     69       2.4683      0.00000
     70       2.4697      0.00000
     71       2.5390      0.00000
     72       2.5479      0.00000

 k-point    13 :       0.1224    0.0000    0.0000
  band No.  band energies     occupation 
      1     -36.4088      1.00000
      2     -36.4075      1.00000
      3     -36.2751      1.00000
      4     -36.2748      1.00000
      5     -23.9357      1.00000
      6     -23.9356      1.00000
      7     -23.9298      1.00000
      8     -23.9286      1.00000
      9     -22.9117      1.00000
     10     -22.9095      1.00000
     11     -22.8955      1.00000
     12     -22.8952      1.00000
     13     -22.8887      1.00000
     14     -22.8886      1.00000
     15     -19.3571      1.00000
     16     -19.3198      1.00000
     17     -19.0261      1.00000
     18     -19.0228      1.00000
     19     -18.3303      1.00000
     20     -18.2840      1.00000
     21     -17.9964      1.00000
     22     -17.9951      1.00000
     23     -17.9197      1.00000
     24     -17.8859      1.00000
     25     -17.8536      1.00000
     26     -17.8402      1.00000
     27     -15.4131      1.00000
     28     -15.4063      1.00000
     29     -14.4738      1.00000
     30     -14.4628      1.00000
     31     -12.9855      1.00000
     32     -12.9736      1.00000
     33      -8.3193      1.00000
     34      -8.3166      1.00000
     35      -4.5623      1.00000
     36      -4.4278      1.00000
     37      -4.1074      1.00000
     38      -3.9575      1.00000
     39      -3.7124      1.00000
     40      -3.6474      1.00000
     41      -3.4932      1.00000
     42      -3.4671      1.00000
     43      -3.3480      1.00000
     44      -3.3201      1.00000
     45      -2.9288      1.00000
     46      -2.9202      1.00000
     47      -2.8551      1.00000
     48      -2.8403      1.00000
     49      -2.6128      1.00000
     50      -2.6097      1.00000
     51      -1.7150      0.99982
     52      -1.6567      0.97283
     53      -1.0889      0.00000
     54      -1.0454      0.00000
     55       0.6198      0.00000
     56       0.6714      0.00000
     57       0.9086      0.00000
     58       0.9187      0.00000
     59       1.2993      0.00000
     60       1.3381      0.00000
     61       1.5038      0.00000
     62       1.5210      0.00000
     63       1.8606      0.00000
     64       1.8648      0.00000
     65       1.9958      0.00000
     66       2.0012      0.00000
     67       2.3631      0.00000
     68       2.3689      0.00000
     69       2.4894      0.00000
     70       2.4916      0.00000
     71       2.5485      0.00000
     72       2.5576      0.00000

 k-point    14 :       0.1327    0.0000    0.0000
  band No.  band energies     occupation 
      1     -36.4078      1.00000
      2     -36.4065      1.00000
      3     -36.2747      1.00000
      4     -36.2744      1.00000
      5     -23.9357      1.00000
      6     -23.9355      1.00000
      7     -23.9298      1.00000
      8     -23.9286      1.00000
      9     -22.9117      1.00000
     10     -22.9094      1.00000
     11     -22.8958      1.00000
     12     -22.8955      1.00000
     13     -22.8884      1.00000
     14     -22.8883      1.00000
     15     -19.3583      1.00000
     16     -19.3180      1.00000
     17     -19.0312      1.00000
     18     -19.0283      1.00000
     19     -18.3333      1.00000
     20     -18.2834      1.00000
     21     -18.0054      1.00000
     22     -18.0030      1.00000
     23     -17.9242      1.00000
     24     -17.8869      1.00000
     25     -17.8581      1.00000
     26     -17.8426      1.00000
     27     -15.3934      1.00000
     28     -15.3863      1.00000
     29     -14.4615      1.00000
     30     -14.4499      1.00000
     31     -12.9800      1.00000
     32     -12.9672      1.00000
     33      -8.3251      1.00000
     34      -8.3225      1.00000
     35      -4.6012      1.00000
     36      -4.4644      1.00000
     37      -4.1659      1.00000
     38      -4.0314      1.00000
     39      -3.7651      1.00000
     40      -3.6810      1.00000
     41      -3.5223      1.00000
     42      -3.4971      1.00000
     43      -3.3898      1.00000
     44      -3.3621      1.00000
     45      -2.9323      1.00000
     46      -2.9215      1.00000
     47      -2.8582      1.00000
     48      -2.8415      1.00000
     49      -2.6123      1.00000
     50      -2.6090      1.00000
     51      -1.6785      0.99446
     52      -1.6203      0.81422
     53      -1.0667      0.00000
     54      -1.0253      0.00000
     55       0.6318      0.00000
     56       0.6842      0.00000
     57       0.9593      0.00000
     58       0.9696      0.00000
     59       1.2589      0.00000
     60       1.2944      0.00000
     61       1.5334      0.00000
     62       1.5589      0.00000
     63       1.9009      0.00000
     64       1.9035      0.00000
     65       2.0349      0.00000
     66       2.0400      0.00000
     67       2.3905      0.00000
     68       2.3950      0.00000
     69       2.5148      0.00000
     70       2.5388      0.00000
     71       2.5553      0.00000
     72       2.5640      0.00000

 k-point    15 :       0.1429    0.0000    0.0000
  band No.  band energies     occupation 
      1     -36.4068      1.00000
      2     -36.4055      1.00000
      3     -36.2742      1.00000
      4     -36.2739      1.00000
      5     -23.9356      1.00000
      6     -23.9354      1.00000
      7     -23.9299      1.00000
      8     -23.9286      1.00000
      9     -22.9118      1.00000
     10     -22.9093      1.00000
     11     -22.8961      1.00000
     12     -22.8957      1.00000
     13     -22.8881      1.00000
     14     -22.8880      1.00000
     15     -19.3595      1.00000
     16     -19.3163      1.00000
     17     -19.0366      1.00000
     18     -19.0342      1.00000
     19     -18.3364      1.00000
     20     -18.2829      1.00000
     21     -18.0148      1.00000
     22     -18.0112      1.00000
     23     -17.9293      1.00000
     24     -17.8893      1.00000
     25     -17.8618      1.00000
     26     -17.8448      1.00000
     27     -15.3723      1.00000
     28     -15.3648      1.00000
     29     -14.4486      1.00000
     30     -14.4364      1.00000
     31     -12.9742      1.00000
     32     -12.9606      1.00000
     33      -8.3321      1.00000
     34      -8.3295      1.00000
     35      -4.6518      1.00000
     36      -4.5258      1.00000
     37      -4.2032      1.00000
     38      -4.0989      1.00000
     39      -3.8208      1.00000
     40      -3.7169      1.00000
     41      -3.5563      1.00000
     42      -3.5310      1.00000
     43      -3.4199      1.00000
     44      -3.3941      1.00000
     45      -2.9365      1.00000
     46      -2.9235      1.00000
     47      -2.8601      1.00000
     48      -2.8420      1.00000
     49      -2.6117      1.00000
     50      -2.6082      1.00000
     51      -1.6412      0.93140
     52      -1.5830      0.43654
     53      -1.0526      0.00000
     54      -1.0139      0.00000
     55       0.6395      0.00000
     56       0.6902      0.00000
     57       1.0073      0.00000
     58       1.0200      0.00000
     59       1.2137      0.00000
     60       1.2483      0.00000
     61       1.5785      0.00000
     62       1.6090      0.00000
     63       1.9396      0.00000
     64       1.9463      0.00000
     65       2.0792      0.00000
     66       2.0842      0.00000
     67       2.4170      0.00000
     68       2.4196      0.00000
     69       2.5355      0.00000
     70       2.5477      0.00000
     71       2.5568      0.00000
     72       2.6360      0.00000

 k-point    16 :       0.1531    0.0000    0.0000
  band No.  band energies     occupation 
      1     -36.4057      1.00000
      2     -36.4044      1.00000
      3     -36.2737      1.00000
      4     -36.2734      1.00000
      5     -23.9355      1.00000
      6     -23.9353      1.00000
      7     -23.9299      1.00000
      8     -23.9286      1.00000
      9     -22.9119      1.00000
     10     -22.9092      1.00000
     11     -22.8963      1.00000
     12     -22.8959      1.00000
     13     -22.8878      1.00000
     14     -22.8877      1.00000
     15     -19.3607      1.00000
     16     -19.3147      1.00000
     17     -19.0422      1.00000
     18     -19.0405      1.00000
     19     -18.3395      1.00000
     20     -18.2825      1.00000
     21     -18.0246      1.00000
     22     -18.0195      1.00000
     23     -17.9349      1.00000
     24     -17.8932      1.00000
     25     -17.8644      1.00000
     26     -17.8468      1.00000
     27     -15.3498      1.00000
     28     -15.3419      1.00000
     29     -14.4349      1.00000
     30     -14.4222      1.00000
     31     -12.9681      1.00000
     32     -12.9539      1.00000
     33      -8.3404      1.00000
     34      -8.3379      1.00000
     35      -4.7138      1.00000
     36      -4.6066      1.00000
     37      -4.2249      1.00000
     38      -4.1610      1.00000
     39      -3.8773      1.00000
     40      -3.7521      1.00000
     41      -3.5964      1.00000
     42      -3.5696      1.00000
     43      -3.4378      1.00000
     44      -3.4154      1.00000
     45      -2.9411      1.00000
     46      -2.9264      1.00000
     47      -2.8614      1.00000
     48      -2.8420      1.00000
     49      -2.6109      1.00000
     50      -2.6073      1.00000
     51      -1.6031      0.65868
     52      -1.5449      0.10790
     53      -1.0470      0.00000
     54      -1.0114      0.00000
     55       0.6448      0.00000
     56       0.6921      0.00000
     57       1.0515      0.00000
     58       1.0659      0.00000
     59       1.1680      0.00000
     60       1.2049      0.00000
     61       1.6329      0.00000
     62       1.6668      0.00000
     63       1.9781      0.00000
     64       1.9899      0.00000
     65       2.1286      0.00000
     66       2.1337      0.00000
     67       2.4365      0.00000
     68       2.4462      0.00000
     69       2.5475      0.00000
     70       2.5576      0.00000
     71       2.5662      0.00000
     72       2.6466      0.00000

 k-point    17 :       0.1633    0.0000    0.0000
  band No.  band energies     occupation 
      1     -36.4046      1.00000
      2     -36.4033      1.00000
      3     -36.2731      1.00000
      4     -36.2729      1.00000
      5     -23.9355      1.00000
      6     -23.9352      1.00000
      7     -23.9299      1.00000
      8     -23.9286      1.00000
      9     -22.9121      1.00000
     10     -22.9091      1.00000
     11     -22.8966      1.00000
     12     -22.8962      1.00000
     13     -22.8874      1.00000
     14     -22.8873      1.00000
     15     -19.3620      1.00000
     16     -19.3132      1.00000
     17     -19.0482      1.00000
     18     -19.0473      1.00000
     19     -18.3426      1.00000
     20     -18.2821      1.00000
     21     -18.0346      1.00000
     22     -18.0279      1.00000
     23     -17.9409      1.00000
     24     -17.8984      1.00000
     25     -17.8660      1.00000
     26     -17.8486      1.00000
     27     -15.3259      1.00000
     28     -15.3177      1.00000
     29     -14.4206      1.00000
     30     -14.4075      1.00000
     31     -12.9619      1.00000
     32     -12.9470      1.00000
     33      -8.3500      1.00000
     34      -8.3476      1.00000
     35      -4.7857      1.00000
     36      -4.6985      1.00000
     37      -4.2413      1.00000
     38      -4.2195      1.00000
     39      -3.9312      1.00000
     40      -3.7841      1.00000
     41      -3.6404      1.00000
     42      -3.6115      1.00000
     43      -3.4462      1.00000
     44      -3.4277      1.00000
     45      -2.9462      1.00000
     46      -2.9303      1.00000
     47      -2.8623      1.00000
     48      -2.8417      1.00000
     49      -2.6099      1.00000
     50      -2.6061      1.00000
     51      -1.5642      0.24426
     52      -1.5059      0.00961
     53      -1.0501      0.00000
     54      -1.0180      0.00000
     55       0.6486      0.00000
     56       0.6910      0.00000
     57       1.0842      0.00000
     58       1.0959      0.00000
     59       1.1330      0.00000
     60       1.1766      0.00000
     61       1.6918      0.00000
     62       1.7284      0.00000
     63       2.0157      0.00000
     64       2.0332      0.00000
     65       2.1827      0.00000
     66       2.1876      0.00000
     67       2.4480      0.00000
     68       2.4513      0.00000
     69       2.5510      0.00000
     70       2.5572      0.00000
     71       2.5947      0.00000
     72       2.6338      0.00000

 k-point    18 :       0.1735    0.0000    0.0000
  band No.  band energies     occupation 
      1     -36.4034      1.00000
      2     -36.4021      1.00000
      3     -36.2726      1.00000
      4     -36.2723      1.00000
      5     -23.9355      1.00000
      6     -23.9351      1.00000
      7     -23.9300      1.00000
      8     -23.9286      1.00000
      9     -22.9122      1.00000
     10     -22.9091      1.00000
     11     -22.8969      1.00000
     12     -22.8964      1.00000
     13     -22.8871      1.00000
     14     -22.8869      1.00000
     15     -19.3632      1.00000
     16     -19.3118      1.00000
     17     -19.0544      1.00000
     18     -19.0543      1.00000
     19     -18.3457      1.00000
     20     -18.2818      1.00000
     21     -18.0448      1.00000
     22     -18.0364      1.00000
     23     -17.9472      1.00000
     24     -17.9046      1.00000
     25     -17.8669      1.00000
     26     -17.8503      1.00000
     27     -15.3007      1.00000
     28     -15.2922      1.00000
     29     -14.4057      1.00000
     30     -14.3923      1.00000
     31     -12.9555      1.00000
     32     -12.9400      1.00000
     33      -8.3611      1.00000
     34      -8.3590      1.00000
     35      -4.8651      1.00000
     36      -4.7957      1.00000
     37      -4.2766      1.00000
     38      -4.2607      1.00000
     39      -3.9782      1.00000
     40      -3.8114      1.00000
     41      -3.6860      1.00000
     42      -3.6548      1.00000
     43      -3.4481      1.00000
     44      -3.4332      1.00000
     45      -2.9516      1.00000
     46      -2.9352      1.00000
     47      -2.8633      1.00000
     48      -2.8413      1.00000
     49      -2.6084      1.00000
     50      -2.6045      1.00000
     51      -1.5244      0.03453
     52      -1.4660      0.00026
     53      -1.0617      0.00000
     54      -1.0331      0.00000
     55       0.6506      0.00000
     56       0.6873      0.00000
     57       1.0664      0.00000
     58       1.0830      0.00000
     59       1.1518      0.00000
     60       1.1907      0.00000
     61       1.7509      0.00000
     62       1.7901      0.00000
     63       2.0517      0.00000
     64       2.0747      0.00000
     65       2.2408      0.00000
     66       2.2456      0.00000
     67       2.4283      0.00000
     68       2.4464      0.00000
     69       2.5696      0.00000
     70       2.5748      0.00000
     71       2.6233      0.00000
     72       2.7009      0.00000

 k-point    19 :       0.1837    0.0000    0.0000
  band No.  band energies     occupation 
      1     -36.4021      1.00000
      2     -36.4008      1.00000
      3     -36.2720      1.00000
      4     -36.2718      1.00000
      5     -23.9355      1.00000
      6     -23.9350      1.00000
      7     -23.9299      1.00000
      8     -23.9286      1.00000
      9     -22.9124      1.00000
     10     -22.9091      1.00000
     11     -22.8971      1.00000
     12     -22.8966      1.00000
     13     -22.8867      1.00000
     14     -22.8865      1.00000
     15     -19.3645      1.00000
     16     -19.3104      1.00000
     17     -19.0619      1.00000
     18     -19.0606      1.00000
     19     -18.3487      1.00000
     20     -18.2816      1.00000
     21     -18.0553      1.00000
     22     -18.0449      1.00000
     23     -17.9538      1.00000
     24     -17.9115      1.00000
     25     -17.8675      1.00000
     26     -17.8519      1.00000
     27     -15.2742      1.00000
     28     -15.2655      1.00000
     29     -14.3904      1.00000
     30     -14.3767      1.00000
     31     -12.9490      1.00000
     32     -12.9329      1.00000
     33      -8.3739      1.00000
     34      -8.3720      1.00000
     35      -4.9496      1.00000
     36      -4.8950      1.00000
     37      -4.3341      1.00000
     38      -4.2895      1.00000
     39      -4.0143      1.00000
     40      -3.8335      1.00000
     41      -3.7316      1.00000
     42      -3.6980      1.00000
     43      -3.4455      1.00000
     44      -3.4339      1.00000
     45      -2.9574      1.00000
     46      -2.9411      1.00000
     47      -2.8643      1.00000
     48      -2.8409      1.00000
     49      -2.6065      1.00000
     50      -2.6026      1.00000
     51      -1.4838      0.00151
     52      -1.4254      0.00000
     53      -1.0812      0.00000
     54      -1.0560      0.00000
     55       0.6498      0.00000
     56       0.6801      0.00000
     57       1.0300      0.00000
     58       1.0519      0.00000
     59       1.1911      0.00000
     60       1.2282      0.00000
     61       1.8073      0.00000
     62       1.8486      0.00000
     63       2.0854      0.00000
     64       2.1135      0.00000
     65       2.3012      0.00000
     66       2.3060      0.00000
     67       2.4116      0.00000
     68       2.4309      0.00000
     69       2.5942      0.00000
     70       2.5992      0.00000
     71       2.6812      0.00000
     72       2.7385      0.00000

 k-point    20 :       0.1939    0.0000    0.0000
  band No.  band energies     occupation 
      1     -36.4009      1.00000
      2     -36.3996      1.00000
      3     -36.2714      1.00000
      4     -36.2712      1.00000
      5     -23.9355      1.00000
      6     -23.9349      1.00000
      7     -23.9299      1.00000
      8     -23.9287      1.00000
      9     -22.9126      1.00000
     10     -22.9092      1.00000
     11     -22.8974      1.00000
     12     -22.8968      1.00000
     13     -22.8863      1.00000
     14     -22.8860      1.00000
     15     -19.3658      1.00000
     16     -19.3092      1.00000
     17     -19.0697      1.00000
     18     -19.0672      1.00000
     19     -18.3516      1.00000
     20     -18.2814      1.00000
     21     -18.0659      1.00000
     22     -18.0536      1.00000
     23     -17.9605      1.00000
     24     -17.9187      1.00000
     25     -17.8679      1.00000
     26     -17.8535      1.00000
     27     -15.2466      1.00000
     28     -15.2377      1.00000
     29     -14.3746      1.00000
     30     -14.3607      1.00000
     31     -12.9423      1.00000
     32     -12.9258      1.00000
     33      -8.3885      1.00000
     34      -8.3870      1.00000
     35      -5.0371      1.00000
     36      -4.9945      1.00000
     37      -4.3926      1.00000
     38      -4.3300      1.00000
     39      -4.0381      1.00000
     40      -3.8512      1.00000
     41      -3.7757      1.00000
     42      -3.7401      1.00000
     43      -3.4395      1.00000
     44      -3.4308      1.00000
     45      -2.9637      1.00000
     46      -2.9480      1.00000
     47      -2.8654      1.00000
     48      -2.8404      1.00000
     49      -2.6041      1.00000
     50      -2.6002      1.00000
     51      -1.4426      0.00002
     52      -1.3842      0.00000
     53      -1.1077      0.00000
     54      -1.0857      0.00000
     55       0.6447      0.00000
     56       0.6684      0.00000
     57       0.9974      0.00000
     58       1.0219      0.00000
     59       1.2324      0.00000
     60       1.2695      0.00000
     61       1.8590      0.00000
     62       1.9011      0.00000
     63       2.1163      0.00000
     64       2.1478      0.00000
     65       2.3614      0.00000
     66       2.3658      0.00000
     67       2.3956      0.00000
     68       2.4172      0.00000
     69       2.6216      0.00000
     70       2.6302      0.00000
     71       2.6872      0.00000
     72       2.7808      0.00000

 k-point    21 :       0.2041    0.0000    0.0000
  band No.  band energies     occupation 
      1     -36.3996      1.00000
      2     -36.3983      1.00000
      3     -36.2709      1.00000
      4     -36.2706      1.00000
      5     -23.9355      1.00000
      6     -23.9348      1.00000
      7     -23.9299      1.00000
      8     -23.9287      1.00000
      9     -22.9129      1.00000
     10     -22.9093      1.00000
     11     -22.8976      1.00000
     12     -22.8970      1.00000
     13     -22.8859      1.00000
     14     -22.8856      1.00000
     15     -19.3672      1.00000
     16     -19.3082      1.00000
     17     -19.0778      1.00000
     18     -19.0739      1.00000
     19     -18.3545      1.00000
     20     -18.2813      1.00000
     21     -18.0766      1.00000
     22     -18.0622      1.00000
     23     -17.9672      1.00000
     24     -17.9261      1.00000
     25     -17.8682      1.00000
     26     -17.8550      1.00000
     27     -15.2177      1.00000
     28     -15.2086      1.00000
     29     -14.3586      1.00000
     30     -14.3445      1.00000
     31     -12.9357      1.00000
     32     -12.9188      1.00000
     33      -8.4050      1.00000
     34      -8.4039      1.00000
     35      -5.1261      1.00000
     36      -5.0930      1.00000
     37      -4.4521      1.00000
     38      -4.3803      1.00000
     39      -4.0522      1.00000
     40      -3.8680      1.00000
     41      -3.8151      1.00000
     42      -3.7801      1.00000
     43      -3.4310      1.00000
     44      -3.4247      1.00000
     45      -2.9704      1.00000
     46      -2.9559      1.00000
     47      -2.8665      1.00000
     48      -2.8398      1.00000
     49      -2.6012      1.00000
     50      -2.5973      1.00000
     51      -1.4012      0.00000
     52      -1.3433      0.00000
     53      -1.1401      0.00000
     54      -1.1204      0.00000
     55       0.6337      0.00000
     56       0.6512      0.00000
     57       0.9714      0.00000
     58       0.9978      0.00000
     59       1.2739      0.00000
     60       1.3110      0.00000
     61       1.9044      0.00000
     62       1.9449      0.00000
     63       2.1447      0.00000
     64       2.1760      0.00000
     65       2.3820      0.00000
     66       2.4020      0.00000
     67       2.4255      0.00000
     68       2.4290      0.00000
     69       2.6535      0.00000
     70       2.6626      0.00000
     71       2.7112      0.00000
     72       2.7789      0.00000

 k-point    22 :       0.2143    0.0000    0.0000
  band No.  band energies     occupation 
      1     -36.3983      1.00000
      2     -36.3970      1.00000
      3     -36.2703      1.00000
      4     -36.2700      1.00000
      5     -23.9355      1.00000
      6     -23.9348      1.00000
      7     -23.9298      1.00000
      8     -23.9287      1.00000
      9     -22.9131      1.00000
     10     -22.9095      1.00000
     11     -22.8977      1.00000
     12     -22.8971      1.00000
     13     -22.8855      1.00000
     14     -22.8851      1.00000
     15     -19.3685      1.00000
     16     -19.3073      1.00000
     17     -19.0862      1.00000
     18     -19.0808      1.00000
     19     -18.3573      1.00000
     20     -18.2813      1.00000
     21     -18.0874      1.00000
     22     -18.0708      1.00000
     23     -17.9740      1.00000
     24     -17.9337      1.00000
     25     -17.8685      1.00000
     26     -17.8564      1.00000
     27     -15.1878      1.00000
     28     -15.1786      1.00000
     29     -14.3422      1.00000
     30     -14.3280      1.00000
     31     -12.9290      1.00000
     32     -12.9118      1.00000
     33      -8.4236      1.00000
     34      -8.4228      1.00000
     35      -5.2153      1.00000
     36      -5.1899      1.00000
     37      -4.5119      1.00000
     38      -4.4367      1.00000
     39      -4.0608      1.00000
     40      -3.8927      1.00000
     41      -3.8419      1.00000
     42      -3.8170      1.00000
     43      -3.4206      1.00000
     44      -3.4163      1.00000
     45      -2.9775      1.00000
     46      -2.9646      1.00000
     47      -2.8673      1.00000
     48      -2.8390      1.00000
     49      -2.5979      1.00000
     50      -2.5940      1.00000
     51      -1.3605      0.00000
     52      -1.3047      0.00000
     53      -1.1763      0.00000
     54      -1.1569      0.00000
     55       0.6161      0.00000
     56       0.6280      0.00000
     57       0.9523      0.00000
     58       0.9807      0.00000
     59       1.3150      0.00000
     60       1.3516      0.00000
     61       1.9430      0.00000
     62       1.9783      0.00000
     63       2.1712      0.00000
     64       2.1971      0.00000
     65       2.3779      0.00000
     66       2.4024      0.00000
     67       2.4792      0.00000
     68       2.4836      0.00000
     69       2.6871      0.00000
     70       2.6964      0.00000
     71       2.7549      0.00000
     72       2.8042      0.00000

 k-point    23 :       0.2245    0.0000    0.0000
  band No.  band energies     occupation 
      1     -36.3969      1.00000
      2     -36.3956      1.00000
      3     -36.2696      1.00000
      4     -36.2694      1.00000
      5     -23.9355      1.00000
      6     -23.9347      1.00000
      7     -23.9297      1.00000
      8     -23.9287      1.00000
      9     -22.9134      1.00000
     10     -22.9097      1.00000
     11     -22.8979      1.00000
     12     -22.8973      1.00000
     13     -22.8850      1.00000
     14     -22.8846      1.00000
     15     -19.3699      1.00000
     16     -19.3066      1.00000
     17     -19.0948      1.00000
     18     -19.0877      1.00000
     19     -18.3600      1.00000
     20     -18.2813      1.00000
     21     -18.0982      1.00000
     22     -18.0793      1.00000
     23     -17.9807      1.00000
     24     -17.9412      1.00000
     25     -17.8689      1.00000
     26     -17.8578      1.00000
     27     -15.1568      1.00000
     28     -15.1475      1.00000
     29     -14.3258      1.00000
     30     -14.3115      1.00000
     31     -12.9223      1.00000
     32     -12.9048      1.00000
     33      -8.4443      1.00000
     34      -8.4440      1.00000
     35      -5.3038      1.00000
     36      -5.2846      1.00000
     37      -4.5715      1.00000
     38      -4.4958      1.00000
     39      -4.0682      1.00000
     40      -3.9289      1.00000
     41      -3.8532      1.00000
     42      -3.8495      1.00000
     43      -3.4090      1.00000
     44      -3.4060      1.00000
     45      -2.9851      1.00000
     46      -2.9741      1.00000
     47      -2.8678      1.00000
     48      -2.8379      1.00000
     49      -2.5940      1.00000
     50      -2.5902      1.00000
     51      -1.3247      0.00000
     52      -1.2790      0.00000
     53      -1.2112      0.00000
     54      -1.1841      0.00000
     55       0.5923      0.00000
     56       0.5994      0.00000
     57       0.9395      0.00000
     58       0.9702      0.00000
     59       1.3551      0.00000
     60       1.3904      0.00000
     61       1.9743      0.00000
     62       2.0014      0.00000
     63       2.1969      0.00000
     64       2.2118      0.00000
     65       2.3803      0.00000
     66       2.4062      0.00000
     67       2.5293      0.00000
     68       2.5343      0.00000
     69       2.7293      0.00000
     70       2.7375      0.00000
     71       2.7906      0.00000
     72       2.8998      0.00000

 k-point    24 :       0.2347    0.0000    0.0000
  band No.  band energies     occupation 
      1     -36.3955      1.00000
      2     -36.3942      1.00000
      3     -36.2690      1.00000
      4     -36.2688      1.00000
      5     -23.9356      1.00000
      6     -23.9347      1.00000
      7     -23.9296      1.00000
      8     -23.9286      1.00000
      9     -22.9137      1.00000
     10     -22.9100      1.00000
     11     -22.8980      1.00000
     12     -22.8974      1.00000
     13     -22.8845      1.00000
     14     -22.8841      1.00000
     15     -19.3713      1.00000
     16     -19.3060      1.00000
     17     -19.1037      1.00000
     18     -19.0948      1.00000
     19     -18.3626      1.00000
     20     -18.2815      1.00000
     21     -18.1090      1.00000
     22     -18.0878      1.00000
     23     -17.9873      1.00000
     24     -17.9488      1.00000
     25     -17.8693      1.00000
     26     -17.8592      1.00000
     27     -15.1249      1.00000
     28     -15.1155      1.00000
     29     -14.3092      1.00000
     30     -14.2950      1.00000
     31     -12.9156      1.00000
     32     -12.8980      1.00000
     33      -8.4674      1.00000
     34      -8.4672      1.00000
     35      -5.3908      1.00000
     36      -5.3767      1.00000
     37      -4.6299      1.00000
     38      -4.5555      1.00000
     39      -4.0780      1.00000
     40      -3.9694      1.00000
     41      -3.8760      1.00000
     42      -3.8569      1.00000
     43      -3.3970      1.00000
     44      -3.3941      1.00000
     45      -2.9932      1.00000
     46      -2.9842      1.00000
     47      -2.8675      1.00000
     48      -2.8362      1.00000
     49      -2.5898      1.00000
     50      -2.5860      1.00000
     51      -1.3136      0.00000
     52      -1.2924      0.00000
     53      -1.2245      0.00000
     54      -1.1743      0.00000
     55       0.5634      0.00000
     56       0.5667      0.00000
     57       0.9313      0.00000
     58       0.9647      0.00000
     59       1.3931      0.00000
     60       1.4262      0.00000
     61       1.9991      0.00000
     62       2.0170      0.00000
     63       2.2218      0.00000
     64       2.2228      0.00000
     65       2.3859      0.00000
     66       2.4143      0.00000
     67       2.5768      0.00000
     68       2.5814      0.00000
     69       2.7729      0.00000
     70       2.7814      0.00000
     71       2.8395      0.00000
     72       2.9367      0.00000

 k-point    25 :       0.2449    0.0000    0.0000
  band No.  band energies     occupation 
      1     -36.3942      1.00000
      2     -36.3929      1.00000
      3     -36.2684      1.00000
      4     -36.2682      1.00000
      5     -23.9357      1.00000
      6     -23.9347      1.00000
      7     -23.9295      1.00000
      8     -23.9286      1.00000
      9     -22.9140      1.00000
     10     -22.9103      1.00000
     11     -22.8980      1.00000
     12     -22.8975      1.00000
     13     -22.8841      1.00000
     14     -22.8835      1.00000
     15     -19.3728      1.00000
     16     -19.3057      1.00000
     17     -19.1126      1.00000
     18     -19.1019      1.00000
     19     -18.3650      1.00000
     20     -18.2817      1.00000
     21     -18.1196      1.00000
     22     -18.0961      1.00000
     23     -17.9938      1.00000
     24     -17.9562      1.00000
     25     -17.8697      1.00000
     26     -17.8606      1.00000
     27     -15.0921      1.00000
     28     -15.0827      1.00000
     29     -14.2927      1.00000
     30     -14.2786      1.00000
     31     -12.9090      1.00000
     32     -12.8913      1.00000
     33      -8.4929      1.00000
     34      -8.4923      1.00000
     35      -5.4759      1.00000
     36      -5.4660      1.00000
     37      -4.6866      1.00000
     38      -4.6141      1.00000
     39      -4.0926      1.00000
     40      -4.0107      1.00000
     41      -3.8952      1.00000
     42      -3.8572      1.00000
     43      -3.3853      1.00000
     44      -3.3813      1.00000
     45      -3.0017      1.00000
     46      -2.9948      1.00000
     47      -2.8661      1.00000
     48      -2.8337      1.00000
     49      -2.5852      1.00000
     50      -2.5815      1.00000
     51      -1.3449      0.00000
     52      -1.3344      0.00000
     53      -1.1976      0.00000
     54      -1.1372      0.00000
     55       0.5307      0.00000
     56       0.5314      0.00000
     57       0.9262      0.00000
     58       0.9625      0.00000
     59       1.4280      0.00000
     60       1.4579      0.00000
     61       2.0189      0.00000
     62       2.0297      0.00000
     63       2.2322      0.00000
     64       2.2453      0.00000
     65       2.3920      0.00000
     66       2.4225      0.00000
     67       2.6225      0.00000
     68       2.6268      0.00000
     69       2.8211      0.00000
     70       2.8274      0.00000
     71       2.8851      0.00000
     72       2.9228      0.00000

 k-point    26 :       0.2551    0.0000    0.0000
  band No.  band energies     occupation 
      1     -36.3928      1.00000
      2     -36.3915      1.00000
      3     -36.2678      1.00000
      4     -36.2676      1.00000
      5     -23.9358      1.00000
      6     -23.9347      1.00000
      7     -23.9294      1.00000
      8     -23.9286      1.00000
      9     -22.9144      1.00000
     10     -22.9107      1.00000
     11     -22.8981      1.00000
     12     -22.8976      1.00000
     13     -22.8836      1.00000
     14     -22.8830      1.00000
     15     -19.3742      1.00000
     16     -19.3055      1.00000
     17     -19.1216      1.00000
     18     -19.1091      1.00000
     19     -18.3673      1.00000
     20     -18.2820      1.00000
     21     -18.1301      1.00000
     22     -18.1044      1.00000
     23     -18.0000      1.00000
     24     -17.9636      1.00000
     25     -17.8703      1.00000
     26     -17.8620      1.00000
     27     -15.0586      1.00000
     28     -15.0491      1.00000
     29     -14.2763      1.00000
     30     -14.2623      1.00000
     31     -12.9024      1.00000
     32     -12.8848      1.00000
     33      -8.5207      1.00000
     34      -8.5196      1.00000
     35      -5.5588      1.00000
     36      -5.5524      1.00000
     37      -4.7409      1.00000
     38      -4.6707      1.00000
     39      -4.1128      1.00000
     40      -4.0514      1.00000
     41      -3.9069      1.00000
     42      -3.8558      1.00000
     43      -3.3738      1.00000
     44      -3.3685      1.00000
     45      -3.0107      1.00000
     46      -3.0057      1.00000
     47      -2.8632      1.00000
     48      -2.8301      1.00000
     49      -2.5803      1.00000
     50      -2.5766      1.00000
     51      -1.3923      0.00000
     52      -1.3848      0.00000
     53      -1.1558      0.00000
     54      -1.0926      0.00000
     55       0.4943      0.00000
     56       0.4962      0.00000
     57       0.9227      0.00000
     58       0.9618      0.00000
     59       1.4583      0.00000
     60       1.4841      0.00000
     61       2.0360      0.00000
     62       2.0444      0.00000
     63       2.2415      0.00000
     64       2.2663      0.00000
     65       2.3967      0.00000
     66       2.4290      0.00000
     67       2.6677      0.00000
     68       2.6724      0.00000
     69       2.8732      0.00000
     70       2.8799      0.00000
     71       2.9372      0.00000
     72       2.9690      0.00000

 k-point    27 :       0.2653    0.0000    0.0000
  band No.  band energies     occupation 
      1     -36.3914      1.00000
      2     -36.3901      1.00000
      3     -36.2672      1.00000
      4     -36.2670      1.00000
      5     -23.9358      1.00000
      6     -23.9347      1.00000
      7     -23.9293      1.00000
      8     -23.9285      1.00000
      9     -22.9147      1.00000
     10     -22.9110      1.00000
     11     -22.8981      1.00000
     12     -22.8977      1.00000
     13     -22.8831      1.00000
     14     -22.8825      1.00000
     15     -19.3757      1.00000
     16     -19.3056      1.00000
     17     -19.1307      1.00000
     18     -19.1163      1.00000
     19     -18.3694      1.00000
     20     -18.2824      1.00000
     21     -18.1403      1.00000
     22     -18.1124      1.00000
     23     -18.0060      1.00000
     24     -17.9707      1.00000
     25     -17.8708      1.00000
     26     -17.8633      1.00000
     27     -15.0243      1.00000
     28     -15.0149      1.00000
     29     -14.2601      1.00000
     30     -14.2463      1.00000
     31     -12.8960      1.00000
     32     -12.8785      1.00000
     33      -8.5506      1.00000
     34      -8.5491      1.00000
     35      -5.6392      1.00000
     36      -5.6355      1.00000
     37      -4.7922      1.00000
     38      -4.7244      1.00000
     39      -4.1380      1.00000
     40      -4.0914      1.00000
     41      -3.9123      1.00000
     42      -3.8534      1.00000
     43      -3.3632      1.00000
     44      -3.3564      1.00000
     45      -3.0200      1.00000
     46      -3.0169      1.00000
     47      -2.8585      1.00000
     48      -2.8251      1.00000
     49      -2.5752      1.00000
     50      -2.5716      1.00000
     51      -1.4445      0.00002
     52      -1.4383      0.00001
     53      -1.1097      0.00000
     54      -1.0451      0.00000
     55       0.4569      0.00000
     56       0.4605      0.00000
     57       0.9198      0.00000
     58       0.9616      0.00000
     59       1.4828      0.00000
     60       1.5035      0.00000
     61       2.0542      0.00000
     62       2.0633      0.00000
     63       2.2506      0.00000
     64       2.2841      0.00000
     65       2.3997      0.00000
     66       2.4332      0.00000
     67       2.7124      0.00000
     68       2.7176      0.00000
     69       2.9226      0.00000
     70       2.9273      0.00000
     71       2.9725      0.00000
     72       3.0358      0.00000

 k-point    28 :       0.2755    0.0000    0.0000
  band No.  band energies     occupation 
      1     -36.3900      1.00000
      2     -36.3887      1.00000
      3     -36.2666      1.00000
      4     -36.2664      1.00000
      5     -23.9359      1.00000
      6     -23.9347      1.00000
      7     -23.9291      1.00000
      8     -23.9285      1.00000
      9     -22.9151      1.00000
     10     -22.9115      1.00000
     11     -22.8981      1.00000
     12     -22.8977      1.00000
     13     -22.8825      1.00000
     14     -22.8819      1.00000
     15     -19.3771      1.00000
     16     -19.3060      1.00000
     17     -19.1398      1.00000
     18     -19.1235      1.00000
     19     -18.3713      1.00000
     20     -18.2830      1.00000
     21     -18.1503      1.00000
     22     -18.1203      1.00000
     23     -18.0118      1.00000
     24     -17.9777      1.00000
     25     -17.8715      1.00000
     26     -17.8647      1.00000
     27     -14.9894      1.00000
     28     -14.9801      1.00000
     29     -14.2443      1.00000
     30     -14.2307      1.00000
     31     -12.8897      1.00000
     32     -12.8723      1.00000
     33      -8.5826      1.00000
     34      -8.5806      1.00000
     35      -5.7168      1.00000
     36      -5.7155      1.00000
     37      -4.8402      1.00000
     38      -4.7749      1.00000
     39      -4.1665      1.00000
     40      -4.1302      1.00000
     41      -3.9132      1.00000
     42      -3.8504      1.00000
     43      -3.3538      1.00000
     44      -3.3456      1.00000
     45      -3.0298      1.00000
     46      -3.0281      1.00000
     47      -2.8517      1.00000
     48      -2.8186      1.00000
     49      -2.5699      1.00000
     50      -2.5663      1.00000
     51      -1.4986      0.00542
     52      -1.4932      0.00346
     53      -1.0616      0.00000
     54      -0.9959      0.00000
     55       0.4196      0.00000
     56       0.4244      0.00000
     57       0.9170      0.00000
     58       0.9610      0.00000
     59       1.5000      0.00000
     60       1.5156      0.00000
     61       2.0771      0.00000
     62       2.0872      0.00000
     63       2.2591      0.00000
     64       2.2985      0.00000
     65       2.4015      0.00000
     66       2.4356      0.00000
     67       2.7553      0.00000
     68       2.7601      0.00000
     69       2.9699      0.00000
     70       2.9789      0.00000
     71       3.0278      0.00000
     72       3.2170      0.00000

 k-point    29 :       0.2857    0.0000    0.0000
  band No.  band energies     occupation 
      1     -36.3887      1.00000
      2     -36.3874      1.00000
      3     -36.2660      1.00000
      4     -36.2658      1.00000
      5     -23.9360      1.00000
      6     -23.9347      1.00000
      7     -23.9290      1.00000
      8     -23.9284      1.00000
      9     -22.9155      1.00000
     10     -22.9119      1.00000
     11     -22.8981      1.00000
     12     -22.8978      1.00000
     13     -22.8820      1.00000
     14     -22.8814      1.00000
     15     -19.3786      1.00000
     16     -19.3066      1.00000
     17     -19.1487      1.00000
     18     -19.1306      1.00000
     19     -18.3731      1.00000
     20     -18.2838      1.00000
     21     -18.1599      1.00000
     22     -18.1280      1.00000
     23     -18.0173      1.00000
     24     -17.9845      1.00000
     25     -17.8722      1.00000
     26     -17.8661      1.00000
     27     -14.9540      1.00000
     28     -14.9448      1.00000
     29     -14.2288      1.00000
     30     -14.2156      1.00000
     31     -12.8835      1.00000
     32     -12.8664      1.00000
     33      -8.6165      1.00000
     34      -8.6140      1.00000
     35      -5.7922      1.00000
     36      -5.7917      1.00000
     37      -4.8845      1.00000
     38      -4.8218      1.00000
     39      -4.1968      1.00000
     40      -4.1679      1.00000
     41      -3.9113      1.00000
     42      -3.8473      1.00000
     43      -3.3460      1.00000
     44      -3.3365      1.00000
     45      -3.0399      1.00000
     46      -3.0394      1.00000
     47      -2.8426      1.00000
     48      -2.8102      1.00000
     49      -2.5645      1.00000
     50      -2.5610      1.00000
     51      -1.5534      0.15910
     52      -1.5484      0.12733
     53      -1.0122      0.00000
     54      -0.9455      0.00000
     55       0.3829      0.00000
     56       0.3887      0.00000
     57       0.9140      0.00000
     58       0.9596      0.00000
     59       1.5091      0.00000
     60       1.5207      0.00000
     61       2.1057      0.00000
     62       2.1162      0.00000
     63       2.2669      0.00000
     64       2.3097      0.00000
     65       2.4033      0.00000
     66       2.4370      0.00000
     67       2.7932      0.00000
     68       2.7970      0.00000
     69       3.0160      0.00000
     70       3.0303      0.00000
     71       3.0870      0.00000
     72       3.2774      0.00000

 k-point    30 :       0.2959    0.0000    0.0000
  band No.  band energies     occupation 
      1     -36.3873      1.00000
      2     -36.3860      1.00000
      3     -36.2654      1.00000
      4     -36.2652      1.00000
      5     -23.9361      1.00000
      6     -23.9348      1.00000
      7     -23.9288      1.00000
      8     -23.9283      1.00000
      9     -22.9159      1.00000
     10     -22.9124      1.00000
     11     -22.8981      1.00000
     12     -22.8978      1.00000
     13     -22.8815      1.00000
     14     -22.8808      1.00000
     15     -19.3800      1.00000
     16     -19.3075      1.00000
     17     -19.1575      1.00000
     18     -19.1377      1.00000
     19     -18.3747      1.00000
     20     -18.2848      1.00000
     21     -18.1691      1.00000
     22     -18.1355      1.00000
     23     -18.0225      1.00000
     24     -17.9911      1.00000
     25     -17.8729      1.00000
     26     -17.8674      1.00000
     27     -14.9183      1.00000
     28     -14.9091      1.00000
     29     -14.2139      1.00000
     30     -14.2010      1.00000
     31     -12.8775      1.00000
     32     -12.8607      1.00000
     33      -8.6521      1.00000
     34      -8.6491      1.00000
     35      -5.8656      1.00000
     36      -5.8636      1.00000
     37      -4.9250      1.00000
     38      -4.8647      1.00000
     39      -4.2279      1.00000
     40      -4.2042      1.00000
     41      -3.9078      1.00000
     42      -3.8444      1.00000
     43      -3.3401      1.00000
     44      -3.3293      1.00000
     45      -3.0505      1.00000
     46      -3.0502      1.00000
     47      -2.8311      1.00000
     48      -2.7999      1.00000
     49      -2.5591      1.00000
     50      -2.5556      1.00000
     51      -1.6082      0.70924
     52      -1.6033      0.66090
     53      -0.9618      0.00000
     54      -0.8940      0.00000
     55       0.3471      0.00000
     56       0.3536      0.00000
     57       0.9105      0.00000
     58       0.9572      0.00000
     59       1.5096      0.00000
     60       1.5198      0.00000
     61       2.1386      0.00000
     62       2.1490      0.00000
     63       2.2749      0.00000
     64       2.3191      0.00000
     65       2.4060      0.00000
     66       2.4382      0.00000
     67       2.8217      0.00000
     68       2.8264      0.00000
     69       3.0683      0.00000
     70       3.0814      0.00000
     71       3.1301      0.00000
     72       3.2039      0.00000

 k-point    31 :       0.3061    0.0000    0.0000
  band No.  band energies     occupation 
      1     -36.3860      1.00000
      2     -36.3847      1.00000
      3     -36.2648      1.00000
      4     -36.2646      1.00000
      5     -23.9362      1.00000
      6     -23.9349      1.00000
      7     -23.9287      1.00000
      8     -23.9282      1.00000
      9     -22.9162      1.00000
     10     -22.9129      1.00000
     11     -22.8980      1.00000
     12     -22.8978      1.00000
     13     -22.8810      1.00000
     14     -22.8803      1.00000
     15     -19.3814      1.00000
     16     -19.3086      1.00000
     17     -19.1661      1.00000
     18     -19.1446      1.00000
     19     -18.3760      1.00000
     20     -18.2861      1.00000
     21     -18.1778      1.00000
     22     -18.1427      1.00000
     23     -18.0274      1.00000
     24     -17.9974      1.00000
     25     -17.8737      1.00000
     26     -17.8688      1.00000
     27     -14.8822      1.00000
     28     -14.8733      1.00000
     29     -14.1996      1.00000
     30     -14.1870      1.00000
     31     -12.8717      1.00000
     32     -12.8553      1.00000
     33      -8.6891      1.00000
     34      -8.6858      1.00000
     35      -5.9358      1.00000
     36      -5.9326      1.00000
     37      -4.9614      1.00000
     38      -4.9036      1.00000
     39      -4.2589      1.00000
     40      -4.2392      1.00000
     41      -3.9036      1.00000
     42      -3.8418      1.00000
     43      -3.3364      1.00000
     44      -3.3241      1.00000
     45      -3.0615      1.00000
     46      -3.0608      1.00000
     47      -2.8173      1.00000
     48      -2.7877      1.00000
     49      -2.5537      1.00000
     50      -2.5503      1.00000
     51      -1.6624      0.98145
     52      -1.6575      0.97428
     53      -0.9105      0.00000
     54      -0.8416      0.00000
     55       0.3125      0.00000
     56       0.3195      0.00000
     57       0.9066      0.00000
     58       0.9539      0.00000
     59       1.5022      0.00000
     60       1.5139      0.00000
     61       2.1719      0.00000
     62       2.1816      0.00000
     63       2.2864      0.00000
     64       2.3298      0.00000
     65       2.4102      0.00000
     66       2.4398      0.00000
     67       2.8385      0.00000
     68       2.8471      0.00000
     69       3.1235      0.00000
     70       3.1366      0.00000
     71       3.1778      0.00000
     72       3.2468      0.00000

 k-point    32 :       0.3163    0.0000    0.0000
  band No.  band energies     occupation 
      1     -36.3847      1.00000
      2     -36.3834      1.00000
      3     -36.2643      1.00000
      4     -36.2641      1.00000
      5     -23.9363      1.00000
      6     -23.9350      1.00000
      7     -23.9285      1.00000
      8     -23.9281      1.00000
      9     -22.9166      1.00000
     10     -22.9134      1.00000
     11     -22.8980      1.00000
     12     -22.8979      1.00000
     13     -22.8804      1.00000
     14     -22.8797      1.00000
     15     -19.3827      1.00000
     16     -19.3101      1.00000
     17     -19.1744      1.00000
     18     -19.1515      1.00000
     19     -18.3772      1.00000
     20     -18.2877      1.00000
     21     -18.1859      1.00000
     22     -18.1496      1.00000
     23     -18.0320      1.00000
     24     -18.0034      1.00000
     25     -17.8745      1.00000
     26     -17.8701      1.00000
     27     -14.8461      1.00000
     28     -14.8373      1.00000
     29     -14.1860      1.00000
     30     -14.1738      1.00000
     31     -12.8660      1.00000
     32     -12.8501      1.00000
     33      -8.7273      1.00000
     34      -8.7236      1.00000
     35      -6.0026      1.00000
     36      -5.9986      1.00000
     37      -4.9936      1.00000
     38      -4.9384      1.00000
     39      -4.2893      1.00000
     40      -4.2726      1.00000
     41      -3.8993      1.00000
     42      -3.8398      1.00000
     43      -3.3346      1.00000
     44      -3.3208      1.00000
     45      -3.0722      1.00000
     46      -3.0714      1.00000
     47      -2.8014      1.00000
     48      -2.7735      1.00000
     49      -2.5484      1.00000
     50      -2.5450      1.00000
     51      -1.7156      0.99983
     52      -1.7106      0.99972
     53      -0.8583      0.00000
     54      -0.7885      0.00000
     55       0.2791      0.00000
     56       0.2865      0.00000
     57       0.9023      0.00000
     58       0.9496      0.00000
     59       1.4888      0.00000
     60       1.5030      0.00000
     61       2.1986      0.00000
     62       2.2069      0.00000
     63       2.3075      0.00000
     64       2.3476      0.00000
     65       2.4166      0.00000
     66       2.4425      0.00000
     67       2.8450      0.00000
     68       2.8580      0.00000
     69       3.1846      0.00000
     70       3.1963      0.00000
     71       3.2344      0.00000
     72       3.5328      0.00000

 k-point    33 :       0.3265    0.0000    0.0000
  band No.  band energies     occupation 
      1     -36.3835      1.00000
      2     -36.3821      1.00000
      3     -36.2637      1.00000
      4     -36.2635      1.00000
      5     -23.9364      1.00000
      6     -23.9351      1.00000
      7     -23.9284      1.00000
      8     -23.9281      1.00000
      9     -22.9170      1.00000
     10     -22.9139      1.00000
     11     -22.8979      1.00000
     12     -22.8979      1.00000
     13     -22.8799      1.00000
     14     -22.8792      1.00000
     15     -19.3840      1.00000
     16     -19.3120      1.00000
     17     -19.1823      1.00000
     18     -19.1582      1.00000
     19     -18.3781      1.00000
     20     -18.2896      1.00000
     21     -18.1934      1.00000
     22     -18.1564      1.00000
     23     -18.0363      1.00000
     24     -18.0092      1.00000
     25     -17.8754      1.00000
     26     -17.8714      1.00000
     27     -14.8099      1.00000
     28     -14.8013      1.00000
     29     -14.1732      1.00000
     30     -14.1615      1.00000
     31     -12.8605      1.00000
     32     -12.8451      1.00000
     33      -8.7664      1.00000
     34      -8.7624      1.00000
     35      -6.0662      1.00000
     36      -6.0615      1.00000
     37      -5.0218      1.00000
     38      -4.9691      1.00000
     39      -4.3188      1.00000
     40      -4.3045      1.00000
     41      -3.8954      1.00000
     42      -3.8387      1.00000
     43      -3.3348      1.00000
     44      -3.3194      1.00000
     45      -3.0827      1.00000
     46      -3.0821      1.00000
     47      -2.7837      1.00000
     48      -2.7577      1.00000
     49      -2.5432      1.00000
     50      -2.5399      1.00000
     51      -1.7674      1.00000
     52      -1.7622      1.00000
     53      -0.8054      0.00000
     54      -0.7346      0.00000
     55       0.2472      0.00000
     56       0.2548      0.00000
     57       0.8979      0.00000
     58       0.9447      0.00000
     59       1.4707      0.00000
     60       1.4875      0.00000
     61       2.2117      0.00000
     62       2.2201      0.00000
     63       2.3419      0.00000
     64       2.3751      0.00000
     65       2.4275      0.00000
     66       2.4475      0.00000
     67       2.8438      0.00000
     68       2.8602      0.00000
     69       3.2478      0.00000
     70       3.2598      0.00000
     71       3.2793      0.00000
     72       3.3446      0.00000

 k-point    34 :       0.3367    0.0000    0.0000
  band No.  band energies     occupation 
      1     -36.3822      1.00000
      2     -36.3809      1.00000
      3     -36.2632      1.00000
      4     -36.2630      1.00000
      5     -23.9365      1.00000
      6     -23.9352      1.00000
      7     -23.9282      1.00000
      8     -23.9280      1.00000
      9     -22.9174      1.00000
     10     -22.9144      1.00000
     11     -22.8979      1.00000
     12     -22.8978      1.00000
     13     -22.8794      1.00000
     14     -22.8787      1.00000
     15     -19.3851      1.00000
     16     -19.3141      1.00000
     17     -19.1898      1.00000
     18     -19.1647      1.00000
     19     -18.3789      1.00000
     20     -18.2918      1.00000
     21     -18.2001      1.00000
     22     -18.1628      1.00000
     23     -18.0403      1.00000
     24     -18.0146      1.00000
     25     -17.8762      1.00000
     26     -17.8727      1.00000
     27     -14.7738      1.00000
     28     -14.7655      1.00000
     29     -14.1612      1.00000
     30     -14.1501      1.00000
     31     -12.8552      1.00000
     32     -12.8404      1.00000
     33      -8.8059      1.00000
     34      -8.8017      1.00000
     35      -6.1265      1.00000
     36      -6.1214      1.00000
     37      -5.0458      1.00000
     38      -4.9957      1.00000
     39      -4.3472      1.00000
     40      -4.3348      1.00000
     41      -3.8921      1.00000
     42      -3.8385      1.00000
     43      -3.3364      1.00000
     44      -3.3194      1.00000
     45      -3.0929      1.00000
     46      -3.0927      1.00000
     47      -2.7645      1.00000
     48      -2.7406      1.00000
     49      -2.5382      1.00000
     50      -2.5349      1.00000
     51      -1.8175      1.00000
     52      -1.8120      1.00000
     53      -0.7518      0.00000
     54      -0.6801      0.00000
     55       0.2168      0.00000
     56       0.2245      0.00000
     57       0.8934      0.00000
     58       0.9391      0.00000
     59       1.4489      0.00000
     60       1.4679      0.00000
     61       2.2133      0.00000
     62       2.2225      0.00000
     63       2.3826      0.00000
     64       2.4009      0.00000
     65       2.4514      0.00000
     66       2.4595      0.00000
     67       2.8380      0.00000
     68       2.8570      0.00000
     69       3.3108      0.00000
     70       3.3206      0.00000
     71       3.3337      0.00000
     72       3.3406      0.00000

 k-point    35 :       0.3469    0.0000    0.0000
  band No.  band energies     occupation 
      1     -36.3811      1.00000
      2     -36.3797      1.00000
      3     -36.2627      1.00000
      4     -36.2625      1.00000
      5     -23.9366      1.00000
      6     -23.9353      1.00000
      7     -23.9281      1.00000
      8     -23.9279      1.00000
      9     -22.9177      1.00000
     10     -22.9149      1.00000
     11     -22.8979      1.00000
     12     -22.8978      1.00000
     13     -22.8789      1.00000
     14     -22.8782      1.00000
     15     -19.3862      1.00000
     16     -19.3167      1.00000
     17     -19.1968      1.00000
     18     -19.1710      1.00000
     19     -18.3794      1.00000
     20     -18.2945      1.00000
     21     -18.2062      1.00000
     22     -18.1689      1.00000
     23     -18.0439      1.00000
     24     -18.0198      1.00000
     25     -17.8771      1.00000
     26     -17.8740      1.00000
     27     -14.7380      1.00000
     28     -14.7300      1.00000
     29     -14.1503      1.00000
     30     -14.1397      1.00000
     31     -12.8502      1.00000
     32     -12.8360      1.00000
     33      -8.8456      1.00000
     34      -8.8413      1.00000
     35      -6.1834      1.00000
     36      -6.1782      1.00000
     37      -5.0660      1.00000
     38      -5.0184      1.00000
     39      -4.3742      1.00000
     40      -4.3633      1.00000
     41      -3.8898      1.00000
     42      -3.8396      1.00000
     43      -3.3393      1.00000
     44      -3.3206      1.00000
     45      -3.1031      1.00000
     46      -3.1026      1.00000
     47      -2.7445      1.00000
     48      -2.7224      1.00000
     49      -2.5333      1.00000
     50      -2.5300      1.00000
     51      -1.8657      1.00000
     52      -1.8599      1.00000
     53      -0.6976      0.00000
     54      -0.6251      0.00000
     55       0.1879      0.00000
     56       0.1956      0.00000
     57       0.8890      0.00000
     58       0.9332      0.00000
     59       1.4241      0.00000
     60       1.4447      0.00000
     61       2.2087      0.00000
     62       2.2177      0.00000
     63       2.4126      0.00000
     64       2.4148      0.00000
     65       2.4830      0.00000
     66       2.4990      0.00000
     67       2.8304      0.00000
     68       2.8512      0.00000
     69       3.3769      0.00000
     70       3.3849      0.00000
     71       3.3968      0.00000
     72       3.5423      0.00000

 k-point    36 :       0.3571    0.0000    0.0000
  band No.  band energies     occupation 
      1     -36.3799      1.00000
      2     -36.3786      1.00000
      3     -36.2622      1.00000
      4     -36.2620      1.00000
      5     -23.9367      1.00000
      6     -23.9354      1.00000
      7     -23.9280      1.00000
      8     -23.9278      1.00000
      9     -22.9180      1.00000
     10     -22.9154      1.00000
     11     -22.8979      1.00000
     12     -22.8978      1.00000
     13     -22.8784      1.00000
     14     -22.8778      1.00000
     15     -19.3871      1.00000
     16     -19.3196      1.00000
     17     -19.2032      1.00000
     18     -19.1771      1.00000
     19     -18.3796      1.00000
     20     -18.2977      1.00000
     21     -18.2115      1.00000
     22     -18.1748      1.00000
     23     -18.0472      1.00000
     24     -18.0247      1.00000
     25     -17.8780      1.00000
     26     -17.8752      1.00000
     27     -14.7026      1.00000
     28     -14.6950      1.00000
     29     -14.1404      1.00000
     30     -14.1304      1.00000
     31     -12.8453      1.00000
     32     -12.8319      1.00000
     33      -8.8851      1.00000
     34      -8.8806      1.00000
     35      -6.2371      1.00000
     36      -6.2318      1.00000
     37      -5.0824      1.00000
     38      -5.0374      1.00000
     39      -4.3997      1.00000
     40      -4.3902      1.00000
     41      -3.8886      1.00000
     42      -3.8419      1.00000
     43      -3.3430      1.00000
     44      -3.3227      1.00000
     45      -3.1131      1.00000
     46      -3.1120      1.00000
     47      -2.7239      1.00000
     48      -2.7037      1.00000
     49      -2.5286      1.00000
     50      -2.5254      1.00000
     51      -1.9117      1.00000
     52      -1.9056      1.00000
     53      -0.6429      0.00000
     54      -0.5698      0.00000
     55       0.1606      0.00000
     56       0.1682      0.00000
     57       0.8848      0.00000
     58       0.9271      0.00000
     59       1.3967      0.00000
     60       1.4186      0.00000
     61       2.2007      0.00000
     62       2.2089      0.00000
     63       2.4207      0.00000
     64       2.4275      0.00000
     65       2.5277      0.00000
     66       2.5505      0.00000
     67       2.8245      0.00000
     68       2.8468      0.00000
     69       3.4255      0.00000
     70       3.4409      0.00000
     71       3.4491      0.00000
     72       3.5313      0.00000

 k-point    37 :       0.3673    0.0000    0.0000
  band No.  band energies     occupation 
      1     -36.3789      1.00000
      2     -36.3775      1.00000
      3     -36.2618      1.00000
      4     -36.2616      1.00000
      5     -23.9368      1.00000
      6     -23.9355      1.00000
      7     -23.9278      1.00000
      8     -23.9277      1.00000
      9     -22.9183      1.00000
     10     -22.9158      1.00000
     11     -22.8978      1.00000
     12     -22.8977      1.00000
     13     -22.8779      1.00000
     14     -22.8773      1.00000
     15     -19.3878      1.00000
     16     -19.3228      1.00000
     17     -19.2091      1.00000
     18     -19.1830      1.00000
     19     -18.3796      1.00000
     20     -18.3012      1.00000
     21     -18.2160      1.00000
     22     -18.1803      1.00000
     23     -18.0501      1.00000
     24     -18.0293      1.00000
     25     -17.8788      1.00000
     26     -17.8763      1.00000
     27     -14.6679      1.00000
     28     -14.6606      1.00000
     29     -14.1316      1.00000
     30     -14.1222      1.00000
     31     -12.8407      1.00000
     32     -12.8281      1.00000
     33      -8.9239      1.00000
     34      -8.9194      1.00000
     35      -6.2875      1.00000
     36      -6.2823      1.00000
     37      -5.0954      1.00000
     38      -5.0530      1.00000
     39      -4.4237      1.00000
     40      -4.4152      1.00000
     41      -3.8887      1.00000
     42      -3.8456      1.00000
     43      -3.3471      1.00000
     44      -3.3253      1.00000
     45      -3.1227      1.00000
     46      -3.1210      1.00000
     47      -2.7032      1.00000
     48      -2.6847      1.00000
     49      -2.5241      1.00000
     50      -2.5209      1.00000
     51      -1.9552      1.00000
     52      -1.9490      1.00000
     53      -0.5879      0.00000
     54      -0.5142      0.00000
     55       0.1350      0.00000
     56       0.1424      0.00000
     57       0.8809      0.00000
     58       0.9210      0.00000
     59       1.3670      0.00000
     60       1.3897      0.00000
     61       2.1909      0.00000
     62       2.1980      0.00000
     63       2.4257      0.00000
     64       2.4337      0.00000
     65       2.5761      0.00000
     66       2.5996      0.00000
     67       2.8247      0.00000
     68       2.8487      0.00000
     69       3.4740      0.00000
     70       3.4915      0.00000
     71       3.4932      0.00000
     72       3.5129      0.00000

 k-point    38 :       0.3776    0.0000    0.0000
  band No.  band energies     occupation 
      1     -36.3779      1.00000
      2     -36.3765      1.00000
      3     -36.2614      1.00000
      4     -36.2612      1.00000
      5     -23.9369      1.00000
      6     -23.9357      1.00000
      7     -23.9277      1.00000
      8     -23.9276      1.00000
      9     -22.9186      1.00000
     10     -22.9163      1.00000
     11     -22.8978      1.00000
     12     -22.8977      1.00000
     13     -22.8775      1.00000
     14     -22.8769      1.00000
     15     -19.3884      1.00000
     16     -19.3264      1.00000
     17     -19.2143      1.00000
     18     -19.1886      1.00000
     19     -18.3794      1.00000
     20     -18.3051      1.00000
     21     -18.2197      1.00000
     22     -18.1856      1.00000
     23     -18.0528      1.00000
     24     -18.0335      1.00000
     25     -17.8796      1.00000
     26     -17.8775      1.00000
     27     -14.6340      1.00000
     28     -14.6271      1.00000
     29     -14.1241      1.00000
     30     -14.1152      1.00000
     31     -12.8364      1.00000
     32     -12.8246      1.00000
     33      -8.9617      1.00000
     34      -8.9573      1.00000
     35      -6.3345      1.00000
     36      -6.3294      1.00000
     37      -5.1051      1.00000
     38      -5.0654      1.00000
     39      -4.4459      1.00000
     40      -4.4385      1.00000
     41      -3.8901      1.00000
     42      -3.8506      1.00000
     43      -3.3512      1.00000
     44      -3.3282      1.00000
     45      -3.1318      1.00000
     46      -3.1294      1.00000
     47      -2.6827      1.00000
     48      -2.6658      1.00000
     49      -2.5199      1.00000
     50      -2.5167      1.00000
     51      -1.9963      1.00000
     52      -1.9899      1.00000
     53      -0.5326      0.00000
     54      -0.4586      0.00000
     55       0.1111      0.00000
     56       0.1181      0.00000
     57       0.8774      0.00000
     58       0.9149      0.00000
     59       1.3353      0.00000
     60       1.3584      0.00000
     61       2.1799      0.00000
     62       2.1859      0.00000
     63       2.4295      0.00000
     64       2.4373      0.00000
     65       2.6163      0.00000
     66       2.6380      0.00000
     67       2.8374      0.00000
     68       2.8637      0.00000
     69       3.5158      0.00000
     70       3.5258      0.00000
     71       3.5399      0.00000
     72       3.6045      0.00000

 k-point    39 :       0.3878    0.0000    0.0000
  band No.  band energies     occupation 
      1     -36.3769      1.00000
      2     -36.3756      1.00000
      3     -36.2610      1.00000
      4     -36.2608      1.00000
      5     -23.9369      1.00000
      6     -23.9358      1.00000
      7     -23.9276      1.00000
      8     -23.9275      1.00000
      9     -22.9189      1.00000
     10     -22.9168      1.00000
     11     -22.8978      1.00000
     12     -22.8976      1.00000
     13     -22.8771      1.00000
     14     -22.8765      1.00000
     15     -19.3888      1.00000
     16     -19.3303      1.00000
     17     -19.2188      1.00000
     18     -19.1940      1.00000
     19     -18.3790      1.00000
     20     -18.3092      1.00000
     21     -18.2228      1.00000
     22     -18.1906      1.00000
     23     -18.0551      1.00000
     24     -18.0375      1.00000
     25     -17.8804      1.00000
     26     -17.8785      1.00000
     27     -14.6010      1.00000
     28     -14.5946      1.00000
     29     -14.1177      1.00000
     30     -14.1095      1.00000
     31     -12.8322      1.00000
     32     -12.8214      1.00000
     33      -8.9982      1.00000
     34      -8.9938      1.00000
     35      -6.3780      1.00000
     36      -6.3732      1.00000
     37      -5.1119      1.00000
     38      -5.0750      1.00000
     39      -4.4664      1.00000
     40      -4.4599      1.00000
     41      -3.8929      1.00000
     42      -3.8570      1.00000
     43      -3.3550      1.00000
     44      -3.3312      1.00000
     45      -3.1401      1.00000
     46      -3.1372      1.00000
     47      -2.6629      1.00000
     48      -2.6473      1.00000
     49      -2.5159      1.00000
     50      -2.5128      1.00000
     51      -2.0345      1.00000
     52      -2.0281      1.00000
     53      -0.4774      0.00000
     54      -0.4034      0.00000
     55       0.0889      0.00000
     56       0.0956      0.00000
     57       0.8743      0.00000
     58       0.9091      0.00000
     59       1.3018      0.00000
     60       1.3249      0.00000
     61       2.1685      0.00000
     62       2.1735      0.00000
     63       2.4326      0.00000
     64       2.4397      0.00000
     65       2.6410      0.00000
     66       2.6601      0.00000
     67       2.8682      0.00000
     68       2.8969      0.00000
     69       3.5394      0.00000
     70       3.5515      0.00000
     71       3.5766      0.00000
     72       3.7456      0.00000

 k-point    40 :       0.3980    0.0000    0.0000
  band No.  band energies     occupation 
      1     -36.3760      1.00000
      2     -36.3747      1.00000
      3     -36.2606      1.00000
      4     -36.2604      1.00000
      5     -23.9370      1.00000
      6     -23.9359      1.00000
      7     -23.9275      1.00000
      8     -23.9274      1.00000
      9     -22.9191      1.00000
     10     -22.9172      1.00000
     11     -22.8978      1.00000
     12     -22.8976      1.00000
     13     -22.8767      1.00000
     14     -22.8762      1.00000
     15     -19.3890      1.00000
     16     -19.3344      1.00000
     17     -19.2228      1.00000
     18     -19.1991      1.00000
     19     -18.3783      1.00000
     20     -18.3137      1.00000
     21     -18.2252      1.00000
     22     -18.1952      1.00000
     23     -18.0572      1.00000
     24     -18.0411      1.00000
     25     -17.8812      1.00000
     26     -17.8795      1.00000
     27     -14.5693      1.00000
     28     -14.5633      1.00000
     29     -14.1125      1.00000
     30     -14.1050      1.00000
     31     -12.8284      1.00000
     32     -12.8185      1.00000
     33      -9.0328      1.00000
     34      -9.0287      1.00000
     35      -6.4181      1.00000
     36      -6.4136      1.00000
     37      -5.1162      1.00000
     38      -5.0822      1.00000
     39      -4.4851      1.00000
     40      -4.4794      1.00000
     41      -3.8969      1.00000
     42      -3.8645      1.00000
     43      -3.3583      1.00000
     44      -3.3342      1.00000
     45      -3.1478      1.00000
     46      -3.1445      1.00000
     47      -2.6440      1.00000
     48      -2.6296      1.00000
     49      -2.5122      1.00000
     50      -2.5090      1.00000
     51      -2.0700      1.00000
     52      -2.0637      1.00000
     53      -0.4225      0.00000
     54      -0.3488      0.00000
     55       0.0686      0.00000
     56       0.0747      0.00000
     57       0.8718      0.00000
     58       0.9036      0.00000
     59       1.2667      0.00000
     60       1.2896      0.00000
     61       2.1570      0.00000
     62       2.1612      0.00000
     63       2.4350      0.00000
     64       2.4415      0.00000
     65       2.6504      0.00000
     66       2.6673      0.00000
     67       2.9159      0.00000
     68       2.9459      0.00000
     69       3.5511      0.00000
     70       3.5603      0.00000
     71       3.6483      0.00000
     72       3.7953      0.00000

 k-point    41 :       0.4082    0.0000    0.0000
  band No.  band energies     occupation 
      1     -36.3752      1.00000
      2     -36.3739      1.00000
      3     -36.2603      1.00000
      4     -36.2601      1.00000
      5     -23.9370      1.00000
      6     -23.9361      1.00000
      7     -23.9274      1.00000
      8     -23.9273      1.00000
      9     -22.9194      1.00000
     10     -22.9176      1.00000
     11     -22.8977      1.00000
     12     -22.8976      1.00000
     13     -22.8763      1.00000
     14     -22.8758      1.00000
     15     -19.3889      1.00000
     16     -19.3387      1.00000
     17     -19.2260      1.00000
     18     -19.2038      1.00000
     19     -18.3773      1.00000
     20     -18.3182      1.00000
     21     -18.2270      1.00000
     22     -18.1996      1.00000
     23     -18.0589      1.00000
     24     -18.0445      1.00000
     25     -17.8819      1.00000
     26     -17.8805      1.00000
     27     -14.5390      1.00000
     28     -14.5335      1.00000
     29     -14.1086      1.00000
     30     -14.1018      1.00000
     31     -12.8248      1.00000
     32     -12.8159      1.00000
     33      -9.0653      1.00000
     34      -9.0614      1.00000
     35      -6.4546      1.00000
     36      -6.4505      1.00000
     37      -5.1184      1.00000
     38      -5.0873      1.00000
     39      -4.5020      1.00000
     40      -4.4969      1.00000
     41      -3.9020      1.00000
     42      -3.8730      1.00000
     43      -3.3609      1.00000
     44      -3.3371      1.00000
     45      -3.1546      1.00000
     46      -3.1511      1.00000
     47      -2.6261      1.00000
     48      -2.6130      1.00000
     49      -2.5086      1.00000
     50      -2.5055      1.00000
     51      -2.1025      1.00000
     52      -2.0965      1.00000
     53      -0.3684      0.00000
     54      -0.2953      0.00000
     55       0.0501      0.00000
     56       0.0557      0.00000
     57       0.8698      0.00000
     58       0.8985      0.00000
     59       1.2305      0.00000
     60       1.2529      0.00000
     61       2.1460      0.00000
     62       2.1494      0.00000
     63       2.4370      0.00000
     64       2.4427      0.00000
     65       2.6501      0.00000
     66       2.6655      0.00000
     67       2.9735      0.00000
     68       3.0040      0.00000
     69       3.5565      0.00000
     70       3.5664      0.00000
     71       3.6587      0.00000
     72       3.7975      0.00000

 k-point    42 :       0.4184    0.0000    0.0000
  band No.  band energies     occupation 
      1     -36.3745      1.00000
      2     -36.3731      1.00000
      3     -36.2600      1.00000
      4     -36.2598      1.00000
      5     -23.9370      1.00000
      6     -23.9362      1.00000
      7     -23.9273      1.00000
      8     -23.9272      1.00000
      9     -22.9195      1.00000
     10     -22.9179      1.00000
     11     -22.8977      1.00000
     12     -22.8975      1.00000
     13     -22.8760      1.00000
     14     -22.8755      1.00000
     15     -19.3885      1.00000
     16     -19.3431      1.00000
     17     -19.2287      1.00000
     18     -19.2083      1.00000
     19     -18.3761      1.00000
     20     -18.3229      1.00000
     21     -18.2283      1.00000
     22     -18.2036      1.00000
     23     -18.0603      1.00000
     24     -18.0475      1.00000
     25     -17.8826      1.00000
     26     -17.8813      1.00000
     27     -14.5105      1.00000
     28     -14.5054      1.00000
     29     -14.1058      1.00000
     30     -14.0997      1.00000
     31     -12.8215      1.00000
     32     -12.8136      1.00000
     33      -9.0954      1.00000
     34      -9.0918      1.00000
     35      -6.4875      1.00000
     36      -6.4838      1.00000
     37      -5.1187      1.00000
     38      -5.0907      1.00000
     39      -4.5170      1.00000
     40      -4.5126      1.00000
     41      -3.9078      1.00000
     42      -3.8823      1.00000
     43      -3.3628      1.00000
     44      -3.3399      1.00000
     45      -3.1605      1.00000
     46      -3.1570      1.00000
     47      -2.6097      1.00000
     48      -2.5976      1.00000
     49      -2.5053      1.00000
     50      -2.5022      1.00000
     51      -2.1320      1.00000
     52      -2.1263      1.00000
     53      -0.3154      0.00000
     54      -0.2435      0.00000
     55       0.0335      0.00000
     56       0.0384      0.00000
     57       0.8684      0.00000
     58       0.8939      0.00000
     59       1.1935      0.00000
     60       1.2151      0.00000
     61       2.1356      0.00000
     62       2.1385      0.00000
     63       2.4386      0.00000
     64       2.4437      0.00000
     65       2.6453      0.00000
     66       2.6594      0.00000
     67       3.0350      0.00000
     68       3.0648      0.00000
     69       3.5618      0.00000
     70       3.5740      0.00000
     71       3.7092      0.00000
     72       3.7684      0.00000

 k-point    43 :       0.4286    0.0000    0.0000
  band No.  band energies     occupation 
      1     -36.3738      1.00000
      2     -36.3725      1.00000
      3     -36.2597      1.00000
      4     -36.2595      1.00000
      5     -23.9371      1.00000
      6     -23.9363      1.00000
      7     -23.9272      1.00000
      8     -23.9271      1.00000
      9     -22.9197      1.00000
     10     -22.9183      1.00000
     11     -22.8977      1.00000
     12     -22.8975      1.00000
     13     -22.8757      1.00000
     14     -22.8753      1.00000
     15     -19.3879      1.00000
     16     -19.3475      1.00000
     17     -19.2308      1.00000
     18     -19.2124      1.00000
     19     -18.3747      1.00000
     20     -18.3275      1.00000
     21     -18.2292      1.00000
     22     -18.2074      1.00000
     23     -18.0615      1.00000
     24     -18.0503      1.00000
     25     -17.8832      1.00000
     26     -17.8821      1.00000
     27     -14.4839      1.00000
     28     -14.4794      1.00000
     29     -14.1042      1.00000
     30     -14.0988      1.00000
     31     -12.8185      1.00000
     32     -12.8117      1.00000
     33      -9.1227      1.00000
     34      -9.1194      1.00000
     35      -6.5167      1.00000
     36      -6.5134      1.00000
     37      -5.1177      1.00000
     38      -5.0927      1.00000
     39      -4.5301      1.00000
     40      -4.5264      1.00000
     41      -3.9141      1.00000
     42      -3.8919      1.00000
     43      -3.3640      1.00000
     44      -3.3425      1.00000
     45      -3.1657      1.00000
     46      -3.1622      1.00000
     47      -2.5947      1.00000
     48      -2.5837      1.00000
     49      -2.5022      1.00000
     50      -2.4991      1.00000
     51      -2.1584      1.00000
     52      -2.1532      1.00000
     53      -0.2643      0.00000
     54      -0.1942      0.00000
     55       0.0189      0.00000
     56       0.0231      0.00000
     57       0.8677      0.00000
     58       0.8899      0.00000
     59       1.1563      0.00000
     60       1.1769      0.00000
     61       2.1263      0.00000
     62       2.1287      0.00000
     63       2.4399      0.00000
     64       2.4443      0.00000
     65       2.6387      0.00000
     66       2.6515      0.00000
     67       3.0956      0.00000
     68       3.1240      0.00000
     69       3.5690      0.00000
     70       3.5841      0.00000
     71       3.7346      0.00000
     72       3.7501      0.00000

 k-point    44 :       0.4388    0.0000    0.0000
  band No.  band energies     occupation 
      1     -36.3733      1.00000
      2     -36.3719      1.00000
      3     -36.2594      1.00000
      4     -36.2593      1.00000
      5     -23.9371      1.00000
      6     -23.9364      1.00000
      7     -23.9271      1.00000
      8     -23.9271      1.00000
      9     -22.9198      1.00000
     10     -22.9186      1.00000
     11     -22.8976      1.00000
     12     -22.8975      1.00000
     13     -22.8754      1.00000
     14     -22.8750      1.00000
     15     -19.3869      1.00000
     16     -19.3520      1.00000
     17     -19.2324      1.00000
     18     -19.2162      1.00000
     19     -18.3729      1.00000
     20     -18.3321      1.00000
     21     -18.2296      1.00000
     22     -18.2108      1.00000
     23     -18.0624      1.00000
     24     -18.0528      1.00000
     25     -17.8837      1.00000
     26     -17.8828      1.00000
     27     -14.4596      1.00000
     28     -14.4557      1.00000
     29     -14.1034      1.00000
     30     -14.0988      1.00000
     31     -12.8157      1.00000
     32     -12.8101      1.00000
     33      -9.1469      1.00000
     34      -9.1440      1.00000
     35      -6.5421      1.00000
     36      -6.5393      1.00000
     37      -5.1156      1.00000
     38      -5.0939      1.00000
     39      -4.5414      1.00000
     40      -4.5383      1.00000
     41      -3.9205      1.00000
     42      -3.9015      1.00000
     43      -3.3645      1.00000
     44      -3.3450      1.00000
     45      -3.1699      1.00000
     46      -3.1666      1.00000
     47      -2.5814      1.00000
     48      -2.5715      1.00000
     49      -2.4992      1.00000
     50      -2.4963      1.00000
     51      -2.1815      1.00000
     52      -2.1770      1.00000
     53      -0.2159      0.00000
     54      -0.1482      0.00000
     55       0.0065      0.00000
     56       0.0098      0.00000
     57       0.8678      0.00000
     58       0.8868      0.00000
     59       1.1196      0.00000
     60       1.1393      0.00000
     61       2.1181      0.00000
     62       2.1202      0.00000
     63       2.4409      0.00000
     64       2.4447      0.00000
     65       2.6318      0.00000
     66       2.6432      0.00000
     67       3.1517      0.00000
     68       3.1778      0.00000
     69       3.5815      0.00000
     70       3.6000      0.00000
     71       3.7706      0.00000
     72       3.7932      0.00000

 k-point    45 :       0.4490    0.0000    0.0000
  band No.  band energies     occupation 
      1     -36.3728      1.00000
      2     -36.3714      1.00000
      3     -36.2592      1.00000
      4     -36.2591      1.00000
      5     -23.9371      1.00000
      6     -23.9365      1.00000
      7     -23.9271      1.00000
      8     -23.9270      1.00000
      9     -22.9199      1.00000
     10     -22.9189      1.00000
     11     -22.8976      1.00000
     12     -22.8975      1.00000
     13     -22.8751      1.00000
     14     -22.8748      1.00000
     15     -19.3857      1.00000
     16     -19.3563      1.00000
     17     -19.2334      1.00000
     18     -19.2197      1.00000
     19     -18.3710      1.00000
     20     -18.3366      1.00000
     21     -18.2297      1.00000
     22     -18.2139      1.00000
     23     -18.0630      1.00000
     24     -18.0550      1.00000
     25     -17.8841      1.00000
     26     -17.8834      1.00000
     27     -14.4379      1.00000
     28     -14.4346      1.00000
     29     -14.1035      1.00000
     30     -14.0997      1.00000
     31     -12.8133      1.00000
     32     -12.8088      1.00000
     33      -9.1677      1.00000
     34      -9.1653      1.00000
     35      -6.5637      1.00000
     36      -6.5613      1.00000
     37      -5.1128      1.00000
     38      -5.0945      1.00000
     39      -4.5508      1.00000
     40      -4.5483      1.00000
     41      -3.9265      1.00000
     42      -3.9107      1.00000
     43      -3.3643      1.00000
     44      -3.3473      1.00000
     45      -3.1733      1.00000
     46      -3.1704      1.00000
     47      -2.5699      1.00000
     48      -2.5611      1.00000
     49      -2.4964      1.00000
     50      -2.4936      1.00000
     51      -2.2014      1.00000
     52      -2.1975      1.00000
     53      -0.1712      0.00000
     54      -0.1070      0.00000
     55      -0.0038      0.00000
     56      -0.0013      0.00000
     57       0.8687      0.00000
     58       0.8845      0.00000
     59       1.0841      0.00000
     60       1.1034      0.00000
     61       2.1111      0.00000
     62       2.1130      0.00000
     63       2.4418      0.00000
     64       2.4449      0.00000
     65       2.6253      0.00000
     66       2.6353      0.00000
     67       3.2000      0.00000
     68       3.2231      0.00000
     69       3.6010      0.00000
     70       3.6232      0.00000
     71       3.7996      0.00000
     72       3.8372      0.00000

 k-point    46 :       0.4592    0.0000    0.0000
  band No.  band energies     occupation 
      1     -36.3724      1.00000
      2     -36.3710      1.00000
      3     -36.2591      1.00000
      4     -36.2589      1.00000
      5     -23.9371      1.00000
      6     -23.9366      1.00000
      7     -23.9270      1.00000
      8     -23.9270      1.00000
      9     -22.9200      1.00000
     10     -22.9192      1.00000
     11     -22.8976      1.00000
     12     -22.8975      1.00000
     13     -22.8749      1.00000
     14     -22.8747      1.00000
     15     -19.3841      1.00000
     16     -19.3605      1.00000
     17     -19.2339      1.00000
     18     -19.2228      1.00000
     19     -18.3687      1.00000
     20     -18.3409      1.00000
     21     -18.2295      1.00000
     22     -18.2168      1.00000
     23     -18.0633      1.00000
     24     -18.0569      1.00000
     25     -17.8845      1.00000
     26     -17.8839      1.00000
     27     -14.4193      1.00000
     28     -14.4167      1.00000
     29     -14.1041      1.00000
     30     -14.1010      1.00000
     31     -12.8112      1.00000
     32     -12.8078      1.00000
     33      -9.1851      1.00000
     34      -9.1831      1.00000
     35      -6.5814      1.00000
     36      -6.5795      1.00000
     37      -5.1097      1.00000
     38      -5.0949      1.00000
     39      -4.5584      1.00000
     40      -4.5564      1.00000
     41      -3.9318      1.00000
     42      -3.9193      1.00000
     43      -3.3637      1.00000
     44      -3.3497      1.00000
     45      -3.1760      1.00000
     46      -3.1735      1.00000
     47      -2.5603      1.00000
     48      -2.5528      1.00000
     49      -2.4937      1.00000
     50      -2.4913      1.00000
     51      -2.2178      1.00000
     52      -2.2147      1.00000
     53      -0.1316      0.00000
     54      -0.0722      0.00000
     55      -0.0116      0.00000
     56      -0.0096      0.00000
     57       0.8705      0.00000
     58       0.8832      0.00000
     59       1.0509      0.00000
     60       1.0705      0.00000
     61       2.1055      0.00000
     62       2.1073      0.00000
     63       2.4425      0.00000
     64       2.4450      0.00000
     65       2.6197      0.00000
     66       2.6282      0.00000
     67       3.2382      0.00000
     68       3.2581      0.00000
     69       3.6279      0.00000
     70       3.6542      0.00000
     71       3.8306      0.00000
     72       3.9774      0.00000

 k-point    47 :       0.4694    0.0000    0.0000
  band No.  band energies     occupation 
      1     -36.3720      1.00000
      2     -36.3707      1.00000
      3     -36.2590      1.00000
      4     -36.2588      1.00000
      5     -23.9371      1.00000
      6     -23.9367      1.00000
      7     -23.9270      1.00000
      8     -23.9269      1.00000
      9     -22.9200      1.00000
     10     -22.9194      1.00000
     11     -22.8976      1.00000
     12     -22.8975      1.00000
     13     -22.8748      1.00000
     14     -22.8746      1.00000
     15     -19.3822      1.00000
     16     -19.3646      1.00000
     17     -19.2340      1.00000
     18     -19.2255      1.00000
     19     -18.3662      1.00000
     20     -18.3451      1.00000
     21     -18.2289      1.00000
     22     -18.2194      1.00000
     23     -18.0634      1.00000
     24     -18.0586      1.00000
     25     -17.8848      1.00000
     26     -17.8843      1.00000
     27     -14.4042      1.00000
     28     -14.4022      1.00000
     29     -14.1050      1.00000
     30     -14.1026      1.00000
     31     -12.8095      1.00000
     32     -12.8072      1.00000
     33      -9.1987      1.00000
     34      -9.1972      1.00000
     35      -6.5952      1.00000
     36      -6.5938      1.00000
     37      -5.1065      1.00000
     38      -5.0953      1.00000
     39      -4.5642      1.00000
     40      -4.5627      1.00000
     41      -3.9360      1.00000
     42      -3.9267      1.00000
     43      -3.3626      1.00000
     44      -3.3519      1.00000
     45      -3.1779      1.00000
     46      -3.1760      1.00000
     47      -2.5526      1.00000
     48      -2.5465      1.00000
     49      -2.4914      1.00000
     50      -2.4894      1.00000
     51      -2.2307      1.00000
     52      -2.2284      1.00000
     53      -0.0988      0.00000
     54      -0.0471      0.00000
     55      -0.0167      0.00000
     56      -0.0129      0.00000
     57       0.8732      0.00000
     58       0.8830      0.00000
     59       1.0211      0.00000
     60       1.0425      0.00000
     61       2.1011      0.00000
     62       2.1029      0.00000
     63       2.4430      0.00000
     64       2.4449      0.00000
     65       2.6152      0.00000
     66       2.6221      0.00000
     67       3.2657      0.00000
     68       3.2827      0.00000
     69       3.6604      0.00000
     70       3.6898      0.00000
     71       3.8434      0.00000
     72       3.9135      0.00000

 k-point    48 :       0.4796    0.0000    0.0000
  band No.  band energies     occupation 
      1     -36.3718      1.00000
      2     -36.3705      1.00000
      3     -36.2589      1.00000
      4     -36.2587      1.00000
      5     -23.9370      1.00000
      6     -23.9368      1.00000
      7     -23.9269      1.00000
      8     -23.9269      1.00000
      9     -22.9200      1.00000
     10     -22.9196      1.00000
     11     -22.8976      1.00000
     12     -22.8975      1.00000
     13     -22.8746      1.00000
     14     -22.8745      1.00000
     15     -19.3799      1.00000
     16     -19.3683      1.00000
     17     -19.2336      1.00000
     18     -19.2279      1.00000
     19     -18.3635      1.00000
     20     -18.3491      1.00000
     21     -18.2280      1.00000
     22     -18.2216      1.00000
     23     -18.0633      1.00000
     24     -18.0600      1.00000
     25     -17.8850      1.00000
     26     -17.8846      1.00000
     27     -14.3929      1.00000
     28     -14.3915      1.00000
     29     -14.1058      1.00000
     30     -14.1042      1.00000
     31     -12.8081      1.00000
     32     -12.8069      1.00000
     33      -9.2085      1.00000
     34      -9.2074      1.00000
     35      -6.6050      1.00000
     36      -6.6041      1.00000
     37      -5.1035      1.00000
     38      -5.0960      1.00000
     39      -4.5682      1.00000
     40      -4.5673      1.00000
     41      -3.9388      1.00000
     42      -3.9327      1.00000
     43      -3.3611      1.00000
     44      -3.3541      1.00000
     45      -3.1791      1.00000
     46      -3.1778      1.00000
     47      -2.5469      1.00000
     48      -2.5423      1.00000
     49      -2.4894      1.00000
     50      -2.4879      1.00000
     51      -2.2400      1.00000
     52      -2.2384      1.00000
     53      -0.0746      0.00000
     54      -0.0375      0.00000
     55      -0.0185      0.00000
     56      -0.0071      0.00000
     57       0.8766      0.00000
     58       0.8834      0.00000
     59       0.9962      0.00000
     60       1.0213      0.00000
     61       2.0980      0.00000
     62       2.0999      0.00000
     63       2.4436      0.00000
     64       2.4448      0.00000
     65       2.6122      0.00000
     66       2.6174      0.00000
     67       3.2835      0.00000
     68       3.2983      0.00000
     69       3.6935      0.00000
     70       3.7247      0.00000
     71       3.8624      0.00000
     72       4.0914      0.00000

 k-point    49 :       0.4898    0.0000    0.0000
  band No.  band energies     occupation 
      1     -36.3717      1.00000
      2     -36.3703      1.00000
      3     -36.2588      1.00000
      4     -36.2586      1.00000
      5     -23.9370      1.00000
      6     -23.9369      1.00000
      7     -23.9269      1.00000
      8     -23.9269      1.00000
      9     -22.9199      1.00000
     10     -22.9197      1.00000
     11     -22.8975      1.00000
     12     -22.8975      1.00000
     13     -22.8745      1.00000
     14     -22.8745      1.00000
     15     -19.3773      1.00000
     16     -19.3719      1.00000
     17     -19.2328      1.00000
     18     -19.2299      1.00000
     19     -18.3605      1.00000
     20     -18.3528      1.00000
     21     -18.2269      1.00000
     22     -18.2236      1.00000
     23     -18.0629      1.00000
     24     -18.0612      1.00000
     25     -17.8851      1.00000
     26     -17.8848      1.00000
     27     -14.3858      1.00000
     28     -14.3851      1.00000
     29     -14.1062      1.00000
     30     -14.1054      1.00000
     31     -12.8074      1.00000
     32     -12.8066      1.00000
     33      -9.2142      1.00000
     34      -9.2137      1.00000
     35      -6.6108      1.00000
     36      -6.6103      1.00000
     37      -5.1008      1.00000
     38      -5.0971      1.00000
     39      -4.5706      1.00000
     40      -4.5701      1.00000
     41      -3.9399      1.00000
     42      -3.9370      1.00000
     43      -3.3594      1.00000
     44      -3.3562      1.00000
     45      -3.1797      1.00000
     46      -3.1790      1.00000
     47      -2.5431      1.00000
     48      -2.5401      1.00000
     49      -2.4881      1.00000
     50      -2.4870      1.00000
     51      -2.2454      1.00000
     52      -2.2446      1.00000
     53      -0.0602      0.00000
     54      -0.0375      0.00000
     55      -0.0171      0.00000
     56       0.0011      0.00000
     57       0.8801      0.00000
     58       0.8836      0.00000
     59       0.9784      0.00000
     60       1.0087      0.00000
     61       2.0962      0.00000
     62       2.0981      0.00000
     63       2.4440      0.00000
     64       2.4445      0.00000
     65       2.6107      0.00000
     66       2.6142      0.00000
     67       3.2934      0.00000
     68       3.3068      0.00000
     69       3.7188      0.00000
     70       3.7511      0.00000
     71       3.8711      0.00000
     72       4.1226      0.00000

 k-point    50 :       0.5000    0.0000    0.0000
  band No.  band energies     occupation 
      1     -36.3716      1.00000
      2     -36.3703      1.00000
      3     -36.2588      1.00000
      4     -36.2586      1.00000
      5     -23.9370      1.00000
      6     -23.9369      1.00000
      7     -23.9269      1.00000
      8     -23.9269      1.00000
      9     -22.9198      1.00000
     10     -22.9198      1.00000
     11     -22.8975      1.00000
     12     -22.8975      1.00000
     13     -22.8745      1.00000
     14     -22.8745      1.00000
     15     -19.3751      1.00000
     16     -19.3744      1.00000
     17     -19.2316      1.00000
     18     -19.2315      1.00000
     19     -18.3573      1.00000
     20     -18.3563      1.00000
     21     -18.2255      1.00000
     22     -18.2253      1.00000
     23     -18.0623      1.00000
     24     -18.0620      1.00000
     25     -17.8851      1.00000
     26     -17.8849      1.00000
     27     -14.3833      1.00000
     28     -14.3831      1.00000
     29     -14.1062      1.00000
     30     -14.1061      1.00000
     31     -12.8077      1.00000
     32     -12.8059      1.00000
     33      -9.2161      1.00000
     34      -9.2159      1.00000
     35      -6.6127      1.00000
     36      -6.6125      1.00000
     37      -5.0987      1.00000
     38      -5.0986      1.00000
     39      -4.5713      1.00000
     40      -4.5711      1.00000
     41      -3.9396      1.00000
     42      -3.9391      1.00000
     43      -3.3583      1.00000
     44      -3.3575      1.00000
     45      -3.1797      1.00000
     46      -3.1796      1.00000
     47      -2.5413      1.00000
     48      -2.5399      1.00000
     49      -2.4875      1.00000
     50      -2.4868      1.00000
     51      -2.2471      1.00000
     52      -2.2469      1.00000
     53      -0.0541      0.00000
     54      -0.0390      0.00000
     55      -0.0155      0.00000
     56       0.0031      0.00000
     57       0.8825      0.00000
     58       0.8829      0.00000
     59       0.9699      0.00000
     60       1.0063      0.00000
     61       2.0955      0.00000
     62       2.0976      0.00000
     63       2.4442      0.00000
     64       2.4444      0.00000
     65       2.6107      0.00000
     66       2.6126      0.00000
     67       3.2967      0.00000
     68       3.3093      0.00000
     69       3.7287      0.00000
     70       3.7599      0.00000
     71       3.8816      0.00000
     72       3.9104      0.00000

 k-point    51 :       0.5000    0.0000    0.0000
  band No.  band energies     occupation 
      1     -36.3716      1.00000
      2     -36.3703      1.00000
      3     -36.2588      1.00000
      4     -36.2586      1.00000
      5     -23.9370      1.00000
      6     -23.9369      1.00000
      7     -23.9269      1.00000
      8     -23.9269      1.00000
      9     -22.9198      1.00000
     10     -22.9198      1.00000
     11     -22.8975      1.00000
     12     -22.8975      1.00000
     13     -22.8745      1.00000
     14     -22.8745      1.00000
     15     -19.3751      1.00000
     16     -19.3744      1.00000
     17     -19.2316      1.00000
     18     -19.2315      1.00000
     19     -18.3573      1.00000
     20     -18.3563      1.00000
     21     -18.2255      1.00000
     22     -18.2253      1.00000
     23     -18.0623      1.00000
     24     -18.0620      1.00000
     25     -17.8851      1.00000
     26     -17.8849      1.00000
     27     -14.3833      1.00000
     28     -14.3831      1.00000
     29     -14.1062      1.00000
     30     -14.1061      1.00000
     31     -12.8077      1.00000
     32     -12.8059      1.00000
     33      -9.2161      1.00000
     34      -9.2159      1.00000
     35      -6.6127      1.00000
     36      -6.6125      1.00000
     37      -5.0987      1.00000
     38      -5.0986      1.00000
     39      -4.5713      1.00000
     40      -4.5711      1.00000
     41      -3.9396      1.00000
     42      -3.9391      1.00000
     43      -3.3583      1.00000
     44      -3.3575      1.00000
     45      -3.1797      1.00000
     46      -3.1796      1.00000
     47      -2.5413      1.00000
     48      -2.5399      1.00000
     49      -2.4875      1.00000
     50      -2.4868      1.00000
     51      -2.2471      1.00000
     52      -2.2469      1.00000
     53      -0.0541      0.00000
     54      -0.0390      0.00000
     55      -0.0155      0.00000
     56       0.0031      0.00000
     57       0.8825      0.00000
     58       0.8829      0.00000
     59       0.9699      0.00000
     60       1.0063      0.00000
     61       2.0955      0.00000
     62       2.0976      0.00000
     63       2.4442      0.00000
     64       2.4444      0.00000
     65       2.6107      0.00000
     66       2.6126      0.00000
     67       3.2967      0.00000
     68       3.3093      0.00000
     69       3.7287      0.00000
     70       3.7599      0.00000
     71       3.8989      0.00000
     72       4.0507      0.00000

 k-point    52 :       0.4966    0.0068    0.0000
  band No.  band energies     occupation 
      1     -36.3716      1.00000
      2     -36.3703      1.00000
      3     -36.2588      1.00000
      4     -36.2586      1.00000
      5     -23.9370      1.00000
      6     -23.9369      1.00000
      7     -23.9270      1.00000
      8     -23.9269      1.00000
      9     -22.9199      1.00000
     10     -22.9198      1.00000
     11     -22.8976      1.00000
     12     -22.8975      1.00000
     13     -22.8745      1.00000
     14     -22.8745      1.00000
     15     -19.3763      1.00000
     16     -19.3732      1.00000
     17     -19.2320      1.00000
     18     -19.2311      1.00000
     19     -18.3583      1.00000
     20     -18.3553      1.00000
     21     -18.2279      1.00000
     22     -18.2229      1.00000
     23     -18.0637      1.00000
     24     -18.0608      1.00000
     25     -17.8856      1.00000
     26     -17.8846      1.00000
     27     -14.3831      1.00000
     28     -14.3829      1.00000
     29     -14.1063      1.00000
     30     -14.1059      1.00000
     31     -12.8080      1.00000
     32     -12.8056      1.00000
     33      -9.2162      1.00000
     34      -9.2157      1.00000
     35      -6.6123      1.00000
     36      -6.6122      1.00000
     37      -5.1038      1.00000
     38      -5.0942      1.00000
     39      -4.5800      1.00000
     40      -4.5662      1.00000
     41      -3.9403      1.00000
     42      -3.9379      1.00000
     43      -3.3602      1.00000
     44      -3.3559      1.00000
     45      -3.1838      1.00000
     46      -3.1776      1.00000
     47      -2.5420      1.00000
     48      -2.5396      1.00000
     49      -2.4892      1.00000
     50      -2.4859      1.00000
     51      -2.2460      1.00000
     52      -2.2440      1.00000
     53      -0.0538      0.00000
     54      -0.0387      0.00000
     55      -0.0146      0.00000
     56       0.0036      0.00000
     57       0.8845      0.00000
     58       0.8849      0.00000
     59       0.9706      0.00000
     60       1.0062      0.00000
     61       2.0950      0.00000
     62       2.0975      0.00000
     63       2.4370      0.00000
     64       2.4483      0.00000
     65       2.6113      0.00000
     66       2.6139      0.00000
     67       3.2970      0.00000
     68       3.3087      0.00000
     69       3.7284      0.00000
     70       3.7581      0.00000
     71       3.8659      0.00000
     72       3.8759      0.00000

 k-point    53 :       0.4932    0.0136    0.0000
  band No.  band energies     occupation 
      1     -36.3716      1.00000
      2     -36.3703      1.00000
      3     -36.2588      1.00000
      4     -36.2586      1.00000
      5     -23.9370      1.00000
      6     -23.9368      1.00000
      7     -23.9270      1.00000
      8     -23.9268      1.00000
      9     -22.9199      1.00000
     10     -22.9197      1.00000
     11     -22.8976      1.00000
     12     -22.8974      1.00000
     13     -22.8745      1.00000
     14     -22.8745      1.00000
     15     -19.3776      1.00000
     16     -19.3718      1.00000
     17     -19.2324      1.00000
     18     -19.2307      1.00000
     19     -18.3598      1.00000
     20     -18.3540      1.00000
     21     -18.2306      1.00000
     22     -18.2203      1.00000
     23     -18.0653      1.00000
     24     -18.0594      1.00000
     25     -17.8863      1.00000
     26     -17.8843      1.00000
     27     -14.3826      1.00000
     28     -14.3825      1.00000
     29     -14.1063      1.00000
     30     -14.1055      1.00000
     31     -12.8084      1.00000
     32     -12.8050      1.00000
     33      -9.2163      1.00000
     34      -9.2155      1.00000
     35      -6.6115      1.00000
     36      -6.6111      1.00000
     37      -5.1097      1.00000
     38      -5.0904      1.00000
     39      -4.5926      1.00000
     40      -4.5648      1.00000
     41      -3.9407      1.00000
     42      -3.9357      1.00000
     43      -3.3626      1.00000
     44      -3.3544      1.00000
     45      -3.1900      1.00000
     46      -3.1776      1.00000
     47      -2.5433      1.00000
     48      -2.5391      1.00000
     49      -2.4919      1.00000
     50      -2.4857      1.00000
     51      -2.2410      1.00000
     52      -2.2371      1.00000
     53      -0.0530      0.00000
     54      -0.0374      0.00000
     55      -0.0122      0.00000
     56       0.0052      0.00000
     57       0.8903      0.00000
     58       0.8910      0.00000
     59       0.9717      0.00000
     60       1.0065      0.00000
     61       2.0931      0.00000
     62       2.0977      0.00000
     63       2.4263      0.00000
     64       2.4489      0.00000
     65       2.6137      0.00000
     66       2.6175      0.00000
     67       3.2968      0.00000
     68       3.3081      0.00000
     69       3.7270      0.00000
     70       3.7550      0.00000
     71       3.8796      0.00000
     72       3.9858      0.00000

 k-point    54 :       0.4898    0.0204    0.0000
  band No.  band energies     occupation 
      1     -36.3716      1.00000
      2     -36.3702      1.00000
      3     -36.2588      1.00000
      4     -36.2586      1.00000
      5     -23.9371      1.00000
      6     -23.9368      1.00000
      7     -23.9271      1.00000
      8     -23.9268      1.00000
      9     -22.9200      1.00000
     10     -22.9196      1.00000
     11     -22.8976      1.00000
     12     -22.8974      1.00000
     13     -22.8746      1.00000
     14     -22.8745      1.00000
     15     -19.3789      1.00000
     16     -19.3704      1.00000
     17     -19.2327      1.00000
     18     -19.2302      1.00000
     19     -18.3613      1.00000
     20     -18.3527      1.00000
     21     -18.2333      1.00000
     22     -18.2177      1.00000
     23     -18.0670      1.00000
     24     -18.0582      1.00000
     25     -17.8871      1.00000
     26     -17.8841      1.00000
     27     -14.3819      1.00000
     28     -14.3816      1.00000
     29     -14.1061      1.00000
     30     -14.1050      1.00000
     31     -12.8088      1.00000
     32     -12.8043      1.00000
     33      -9.2164      1.00000
     34      -9.2151      1.00000
     35      -6.6099      1.00000
     36      -6.6093      1.00000
     37      -5.1163      1.00000
     38      -5.0872      1.00000
     39      -4.6089      1.00000
     40      -4.5672      1.00000
     41      -3.9406      1.00000
     42      -3.9330      1.00000
     43      -3.3655      1.00000
     44      -3.3532      1.00000
     45      -3.1981      1.00000
     46      -3.1796      1.00000
     47      -2.5449      1.00000
     48      -2.5387      1.00000
     49      -2.4952      1.00000
     50      -2.4863      1.00000
     51      -2.2322      1.00000
     52      -2.2264      1.00000
     53      -0.0516      0.00000
     54      -0.0353      0.00000
     55      -0.0083      0.00000
     56       0.0081      0.00000
     57       0.9000      0.00000
     58       0.9009      0.00000
     59       0.9734      0.00000
     60       1.0073      0.00000
     61       2.0903      0.00000
     62       2.0974      0.00000
     63       2.4125      0.00000
     64       2.4464      0.00000
     65       2.6179      0.00000
     66       2.6230      0.00000
     67       3.2960      0.00000
     68       3.3076      0.00000
     69       3.7226      0.00000
     70       3.7506      0.00000
     71       3.8740      0.00000
     72       4.0132      0.00000

 k-point    55 :       0.4864    0.0272    0.0000
  band No.  band energies     occupation 
      1     -36.3716      1.00000
      2     -36.3702      1.00000
      3     -36.2588      1.00000
      4     -36.2586      1.00000
      5     -23.9371      1.00000
      6     -23.9367      1.00000
      7     -23.9271      1.00000
      8     -23.9267      1.00000
      9     -22.9200      1.00000
     10     -22.9195      1.00000
     11     -22.8977      1.00000
     12     -22.8974      1.00000
     13     -22.8746      1.00000
     14     -22.8745      1.00000
     15     -19.3802      1.00000
     16     -19.3689      1.00000
     17     -19.2331      1.00000
     18     -19.2297      1.00000
     19     -18.3628      1.00000
     20     -18.3514      1.00000
     21     -18.2360      1.00000
     22     -18.2152      1.00000
     23     -18.0688      1.00000
     24     -18.0570      1.00000
     25     -17.8880      1.00000
     26     -17.8840      1.00000
     27     -14.3808      1.00000
     28     -14.3805      1.00000
     29     -14.1059      1.00000
     30     -14.1043      1.00000
     31     -12.8091      1.00000
     32     -12.8034      1.00000
     33      -9.2164      1.00000
     34      -9.2147      1.00000
     35      -6.6077      1.00000
     36      -6.6068      1.00000
     37      -5.1238      1.00000
     38      -5.0846      1.00000
     39      -4.6287      1.00000
     40      -4.5729      1.00000
     41      -3.9399      1.00000
     42      -3.9297      1.00000
     43      -3.3691      1.00000
     44      -3.3522      1.00000
     45      -3.2081      1.00000
     46      -3.1835      1.00000
     47      -2.5470      1.00000
     48      -2.5387      1.00000
     49      -2.4991      1.00000
     50      -2.4875      1.00000
     51      -2.2197      1.00000
     52      -2.2122      1.00000
     53      -0.0498      0.00000
     54      -0.0325      0.00000
     55      -0.0030      0.00000
     56       0.0123      0.00000
     57       0.9133      0.00000
     58       0.9145      0.00000
     59       0.9760      0.00000
     60       1.0088      0.00000
     61       2.0868      0.00000
     62       2.0967      0.00000
     63       2.3957      0.00000
     64       2.4407      0.00000
     65       2.6240      0.00000
     66       2.6307      0.00000
     67       3.2947      0.00000
     68       3.3069      0.00000
     69       3.7175      0.00000
     70       3.7441      0.00000
     71       3.8700      0.00000
     72       3.9130      0.00000

 k-point    56 :       0.4830    0.0340    0.0000
  band No.  band energies     occupation 
      1     -36.3715      1.00000
      2     -36.3702      1.00000
      3     -36.2587      1.00000
      4     -36.2585      1.00000
      5     -23.9371      1.00000
      6     -23.9366      1.00000
      7     -23.9272      1.00000
      8     -23.9267      1.00000
      9     -22.9200      1.00000
     10     -22.9194      1.00000
     11     -22.8978      1.00000
     12     -22.8974      1.00000
     13     -22.8747      1.00000
     14     -22.8745      1.00000
     15     -19.3814      1.00000
     16     -19.3674      1.00000
     17     -19.2334      1.00000
     18     -19.2292      1.00000
     19     -18.3645      1.00000
     20     -18.3503      1.00000
     21     -18.2387      1.00000
     22     -18.2127      1.00000
     23     -18.0707      1.00000
     24     -18.0560      1.00000
     25     -17.8891      1.00000
     26     -17.8841      1.00000
     27     -14.3794      1.00000
     28     -14.3790      1.00000
     29     -14.1055      1.00000
     30     -14.1036      1.00000
     31     -12.8094      1.00000
     32     -12.8025      1.00000
     33      -9.2164      1.00000
     34      -9.2143      1.00000
     35      -6.6049      1.00000
     36      -6.6037      1.00000
     37      -5.1322      1.00000
     38      -5.0825      1.00000
     39      -4.6517      1.00000
     40      -4.5819      1.00000
     41      -3.9387      1.00000
     42      -3.9260      1.00000
     43      -3.3735      1.00000
     44      -3.3517      1.00000
     45      -3.2197      1.00000
     46      -3.1889      1.00000
     47      -2.5493      1.00000
     48      -2.5388      1.00000
     49      -2.5035      1.00000
     50      -2.4895      1.00000
     51      -2.2038      1.00000
     52      -2.1946      1.00000
     53      -0.0476      0.00000
     54      -0.0290      0.00000
     55       0.0037      0.00000
     56       0.0180      0.00000
     57       0.9295      0.00000
     58       0.9315      0.00000
     59       0.9799      0.00000
     60       1.0110      0.00000
     61       2.0827      0.00000
     62       2.0956      0.00000
     63       2.3762      0.00000
     64       2.4321      0.00000
     65       2.6319      0.00000
     66       2.6402      0.00000
     67       3.2929      0.00000
     68       3.3061      0.00000
     69       3.7103      0.00000
     70       3.7380      0.00000
     71       3.8667      0.00000
     72       4.0543      0.00000

 k-point    57 :       0.4796    0.0408    0.0000
  band No.  band energies     occupation 
      1     -36.3715      1.00000
      2     -36.3701      1.00000
      3     -36.2587      1.00000
      4     -36.2585      1.00000
      5     -23.9371      1.00000
      6     -23.9366      1.00000
      7     -23.9273      1.00000
      8     -23.9267      1.00000
      9     -22.9200      1.00000
     10     -22.9192      1.00000
     11     -22.8978      1.00000
     12     -22.8974      1.00000
     13     -22.8748      1.00000
     14     -22.8745      1.00000
     15     -19.3826      1.00000
     16     -19.3659      1.00000
     17     -19.2338      1.00000
     18     -19.2287      1.00000
     19     -18.3661      1.00000
     20     -18.3492      1.00000
     21     -18.2414      1.00000
     22     -18.2103      1.00000
     23     -18.0726      1.00000
     24     -18.0551      1.00000
     25     -17.8903      1.00000
     26     -17.8842      1.00000
     27     -14.3777      1.00000
     28     -14.3772      1.00000
     29     -14.1049      1.00000
     30     -14.1027      1.00000
     31     -12.8096      1.00000
     32     -12.8015      1.00000
     33      -9.2163      1.00000
     34      -9.2138      1.00000
     35      -6.6013      1.00000
     36      -6.5999      1.00000
     37      -5.1416      1.00000
     38      -5.0811      1.00000
     39      -4.6778      1.00000
     40      -4.5939      1.00000
     41      -3.9370      1.00000
     42      -3.9217      1.00000
     43      -3.3790      1.00000
     44      -3.3519      1.00000
     45      -3.2325      1.00000
     46      -3.1956      1.00000
     47      -2.5521      1.00000
     48      -2.5393      1.00000
     49      -2.5081      1.00000
     50      -2.4918      1.00000
     51      -2.1848      1.00000
     52      -2.1738      1.00000
     53      -0.0450      0.00000
     54      -0.0251      0.00000
     55       0.0119      0.00000
     56       0.0251      0.00000
     57       0.9471      0.00000
     58       0.9511      0.00000
     59       0.9866      0.00000
     60       1.0145      0.00000
     61       2.0777      0.00000
     62       2.0941      0.00000
     63       2.3542      0.00000
     64       2.4209      0.00000
     65       2.6414      0.00000
     66       2.6517      0.00000
     67       3.2907      0.00000
     68       3.3049      0.00000
     69       3.7019      0.00000
     70       3.7284      0.00000
     71       3.8700      0.00000
     72       3.9018      0.00000

 k-point    58 :       0.4762    0.0476    0.0000
  band No.  band energies     occupation 
      1     -36.3714      1.00000
      2     -36.3700      1.00000
      3     -36.2587      1.00000
      4     -36.2585      1.00000
      5     -23.9371      1.00000
      6     -23.9365      1.00000
      7     -23.9274      1.00000
      8     -23.9266      1.00000
      9     -22.9200      1.00000
     10     -22.9191      1.00000
     11     -22.8979      1.00000
     12     -22.8974      1.00000
     13     -22.8749      1.00000
     14     -22.8745      1.00000
     15     -19.3838      1.00000
     16     -19.3644      1.00000
     17     -19.2341      1.00000
     18     -19.2282      1.00000
     19     -18.3678      1.00000
     20     -18.3481      1.00000
     21     -18.2440      1.00000
     22     -18.2079      1.00000
     23     -18.0746      1.00000
     24     -18.0542      1.00000
     25     -17.8916      1.00000
     26     -17.8845      1.00000
     27     -14.3757      1.00000
     28     -14.3751      1.00000
     29     -14.1043      1.00000
     30     -14.1017      1.00000
     31     -12.8098      1.00000
     32     -12.8005      1.00000
     33      -9.2162      1.00000
     34      -9.2133      1.00000
     35      -6.5972      1.00000
     36      -6.5954      1.00000
     37      -5.1522      1.00000
     38      -5.0804      1.00000
     39      -4.7065      1.00000
     40      -4.6084      1.00000
     41      -3.9349      1.00000
     42      -3.9169      1.00000
     43      -3.3859      1.00000
     44      -3.3531      1.00000
     45      -3.2460      1.00000
     46      -3.2032      1.00000
     47      -2.5553      1.00000
     48      -2.5401      1.00000
     49      -2.5130      1.00000
     50      -2.4946      1.00000
     51      -2.1630      1.00000
     52      -2.1503      1.00000
     53      -0.0420      0.00000
     54      -0.0208      0.00000
     55       0.0213      0.00000
     56       0.0337      0.00000
     57       0.9618      0.00000
     58       0.9720      0.00000
     59       1.0001      0.00000
     60       1.0208      0.00000
     61       2.0719      0.00000
     62       2.0921      0.00000
     63       2.3300      0.00000
     64       2.4076      0.00000
     65       2.6527      0.00000
     66       2.6651      0.00000
     67       3.2880      0.00000
     68       3.3032      0.00000
     69       3.6932      0.00000
     70       3.7195      0.00000
     71       3.8797      0.00000
     72       3.8986      0.00000

 k-point    59 :       0.4728    0.0544    0.0000
  band No.  band energies     occupation 
      1     -36.3713      1.00000
      2     -36.3700      1.00000
      3     -36.2586      1.00000
      4     -36.2585      1.00000
      5     -23.9372      1.00000
      6     -23.9364      1.00000
      7     -23.9274      1.00000
      8     -23.9266      1.00000
      9     -22.9200      1.00000
     10     -22.9189      1.00000
     11     -22.8980      1.00000
     12     -22.8974      1.00000
     13     -22.8749      1.00000
     14     -22.8746      1.00000
     15     -19.3849      1.00000
     16     -19.3629      1.00000
     17     -19.2343      1.00000
     18     -19.2277      1.00000
     19     -18.3695      1.00000
     20     -18.3472      1.00000
     21     -18.2466      1.00000
     22     -18.2056      1.00000
     23     -18.0766      1.00000
     24     -18.0535      1.00000
     25     -17.8930      1.00000
     26     -17.8849      1.00000
     27     -14.3734      1.00000
     28     -14.3727      1.00000
     29     -14.1035      1.00000
     30     -14.1006      1.00000
     31     -12.8099      1.00000
     32     -12.7994      1.00000
     33      -9.2160      1.00000
     34      -9.2127      1.00000
     35      -6.5923      1.00000
     36      -6.5903      1.00000
     37      -5.1640      1.00000
     38      -5.0803      1.00000
     39      -4.7376      1.00000
     40      -4.6252      1.00000
     41      -3.9324      1.00000
     42      -3.9116      1.00000
     43      -3.3944      1.00000
     44      -3.3560      1.00000
     45      -3.2594      1.00000
     46      -3.2113      1.00000
     47      -2.5589      1.00000
     48      -2.5413      1.00000
     49      -2.5180      1.00000
     50      -2.4975      1.00000
     51      -2.1387      1.00000
     52      -2.1243      1.00000
     53      -0.0386      0.00000
     54      -0.0162      0.00000
     55       0.0321      0.00000
     56       0.0439      0.00000
     57       0.9709      0.00000
     58       0.9902      0.00000
     59       1.0225      0.00000
     60       1.0338      0.00000
     61       2.0653      0.00000
     62       2.0899      0.00000
     63       2.3039      0.00000
     64       2.3925      0.00000
     65       2.6655      0.00000
     66       2.6802      0.00000
     67       3.2850      0.00000
     68       3.3011      0.00000
     69       3.6842      0.00000
     70       3.7107      0.00000
     71       3.8707      0.00000
     72       4.1090      0.00000

 k-point    60 :       0.4694    0.0612    0.0000
  band No.  band energies     occupation 
      1     -36.3712      1.00000
      2     -36.3699      1.00000
      3     -36.2586      1.00000
      4     -36.2584      1.00000
      5     -23.9372      1.00000
      6     -23.9363      1.00000
      7     -23.9275      1.00000
      8     -23.9266      1.00000
      9     -22.9199      1.00000
     10     -22.9188      1.00000
     11     -22.8981      1.00000
     12     -22.8974      1.00000
     13     -22.8750      1.00000
     14     -22.8746      1.00000
     15     -19.3861      1.00000
     16     -19.3613      1.00000
     17     -19.2346      1.00000
     18     -19.2271      1.00000
     19     -18.3712      1.00000
     20     -18.3464      1.00000
     21     -18.2491      1.00000
     22     -18.2033      1.00000
     23     -18.0787      1.00000
     24     -18.0529      1.00000
     25     -17.8946      1.00000
     26     -17.8853      1.00000
     27     -14.3708      1.00000
     28     -14.3700      1.00000
     29     -14.1027      1.00000
     30     -14.0993      1.00000
     31     -12.8099      1.00000
     32     -12.7982      1.00000
     33      -9.2158      1.00000
     34      -9.2121      1.00000
     35      -6.5868      1.00000
     36      -6.5846      1.00000
     37      -5.1772      1.00000
     38      -5.0810      1.00000
     39      -4.7708      1.00000
     40      -4.6438      1.00000
     41      -3.9296      1.00000
     42      -3.9059      1.00000
     43      -3.4048      1.00000
     44      -3.3615      1.00000
     45      -3.2716      1.00000
     46      -3.2194      1.00000
     47      -2.5629      1.00000
     48      -2.5432      1.00000
     49      -2.5227      1.00000
     50      -2.5006      1.00000
     51      -2.1122      1.00000
     52      -2.0962      1.00000
     53      -0.0349      0.00000
     54      -0.0114      0.00000
     55       0.0441      0.00000
     56       0.0555      0.00000
     57       0.9767      0.00000
     58       1.0015      0.00000
     59       1.0511      0.00000
     60       1.0578      0.00000
     61       2.0577      0.00000
     62       2.0873      0.00000
     63       2.2763      0.00000
     64       2.3760      0.00000
     65       2.6797      0.00000
     66       2.6971      0.00000
     67       3.2816      0.00000
     68       3.2985      0.00000
     69       3.6714      0.00000
     70       3.6987      0.00000
     71       3.8666      0.00000
     72       3.9323      0.00000

 k-point    61 :       0.4660    0.0680    0.0000
  band No.  band energies     occupation 
      1     -36.3712      1.00000
      2     -36.3698      1.00000
      3     -36.2586      1.00000
      4     -36.2584      1.00000
      5     -23.9372      1.00000
      6     -23.9362      1.00000
      7     -23.9276      1.00000
      8     -23.9266      1.00000
      9     -22.9199      1.00000
     10     -22.9186      1.00000
     11     -22.8982      1.00000
     12     -22.8974      1.00000
     13     -22.8751      1.00000
     14     -22.8747      1.00000
     15     -19.3871      1.00000
     16     -19.3597      1.00000
     17     -19.2348      1.00000
     18     -19.2266      1.00000
     19     -18.3730      1.00000
     20     -18.3456      1.00000
     21     -18.2516      1.00000
     22     -18.2012      1.00000
     23     -18.0808      1.00000
     24     -18.0524      1.00000
     25     -17.8964      1.00000
     26     -17.8858      1.00000
     27     -14.3679      1.00000
     28     -14.3670      1.00000
     29     -14.1017      1.00000
     30     -14.0980      1.00000
     31     -12.8099      1.00000
     32     -12.7970      1.00000
     33      -9.2156      1.00000
     34      -9.2115      1.00000
     35      -6.5807      1.00000
     36      -6.5782      1.00000
     37      -5.1919      1.00000
     38      -5.0827      1.00000
     39      -4.8055      1.00000
     40      -4.6639      1.00000
     41      -3.9265      1.00000
     42      -3.8998      1.00000
     43      -3.4174      1.00000
     44      -3.3706      1.00000
     45      -3.2814      1.00000
     46      -3.2271      1.00000
     47      -2.5674      1.00000
     48      -2.5460      1.00000
     49      -2.5270      1.00000
     50      -2.5037      1.00000
     51      -2.0839      1.00000
     52      -2.0662      1.00000
     53      -0.0308      0.00000
     54      -0.0063      0.00000
     55       0.0574      0.00000
     56       0.0684      0.00000
     57       0.9812      0.00000
     58       1.0080      0.00000
     59       1.0837      0.00000
     60       1.0904      0.00000
     61       2.0490      0.00000
     62       2.0844      0.00000
     63       2.2475      0.00000
     64       2.3587      0.00000
     65       2.6952      0.00000
     66       2.7155      0.00000
     67       3.2780      0.00000
     68       3.2956      0.00000
     69       3.6588      0.00000
     70       3.6866      0.00000
     71       3.8726      0.00000
     72       3.9082      0.00000

 k-point    62 :       0.4626    0.0748    0.0000
  band No.  band energies     occupation 
      1     -36.3711      1.00000
      2     -36.3697      1.00000
      3     -36.2585      1.00000
      4     -36.2583      1.00000
      5     -23.9371      1.00000
      6     -23.9361      1.00000
      7     -23.9277      1.00000
      8     -23.9265      1.00000
      9     -22.9198      1.00000
     10     -22.9184      1.00000
     11     -22.8983      1.00000
     12     -22.8974      1.00000
     13     -22.8752      1.00000
     14     -22.8747      1.00000
     15     -19.3882      1.00000
     16     -19.3582      1.00000
     17     -19.2351      1.00000
     18     -19.2261      1.00000
     19     -18.3748      1.00000
     20     -18.3450      1.00000
     21     -18.2540      1.00000
     22     -18.1991      1.00000
     23     -18.0829      1.00000
     24     -18.0520      1.00000
     25     -17.8982      1.00000
     26     -17.8864      1.00000
     27     -14.3647      1.00000
     28     -14.3637      1.00000
     29     -14.1006      1.00000
     30     -14.0966      1.00000
     31     -12.8098      1.00000
     32     -12.7957      1.00000
     33      -9.2153      1.00000
     34      -9.2109      1.00000
     35      -6.5739      1.00000
     36      -6.5711      1.00000
     37      -5.2081      1.00000
     38      -5.0854      1.00000
     39      -4.8414      1.00000
     40      -4.6850      1.00000
     41      -3.9233      1.00000
     42      -3.8933      1.00000
     43      -3.4324      1.00000
     44      -3.3838      1.00000
     45      -3.2881      1.00000
     46      -3.2341      1.00000
     47      -2.5723      1.00000
     48      -2.5498      1.00000
     49      -2.5306      1.00000
     50      -2.5067      1.00000
     51      -2.0540      1.00000
     52      -2.0347      1.00000
     53      -0.0264      0.00000
     54      -0.0010      0.00000
     55       0.0719      0.00000
     56       0.0827      0.00000
     57       0.9852      0.00000
     58       1.0126      0.00000
     59       1.1196      0.00000
     60       1.1278      0.00000
     61       2.0391      0.00000
     62       2.0810      0.00000
     63       2.2181      0.00000
     64       2.3412      0.00000
     65       2.7117      0.00000
     66       2.7353      0.00000
     67       3.2743      0.00000
     68       3.2925      0.00000
     69       3.6468      0.00000
     70       3.6737      0.00000
     71       3.8838      0.00000
     72       3.9196      0.00000

 k-point    63 :       0.4592    0.0816    0.0000
  band No.  band energies     occupation 
      1     -36.3709      1.00000
      2     -36.3696      1.00000
      3     -36.2585      1.00000
      4     -36.2583      1.00000
      5     -23.9371      1.00000
      6     -23.9360      1.00000
      7     -23.9278      1.00000
      8     -23.9265      1.00000
      9     -22.9197      1.00000
     10     -22.9182      1.00000
     11     -22.8984      1.00000
     12     -22.8974      1.00000
     13     -22.8753      1.00000
     14     -22.8748      1.00000
     15     -19.3892      1.00000
     16     -19.3566      1.00000
     17     -19.2353      1.00000
     18     -19.2255      1.00000
     19     -18.3766      1.00000
     20     -18.3446      1.00000
     21     -18.2562      1.00000
     22     -18.1970      1.00000
     23     -18.0851      1.00000
     24     -18.0516      1.00000
     25     -17.9002      1.00000
     26     -17.8871      1.00000
     27     -14.3612      1.00000
     28     -14.3602      1.00000
     29     -14.0994      1.00000
     30     -14.0951      1.00000
     31     -12.8096      1.00000
     32     -12.7944      1.00000
     33      -9.2151      1.00000
     34      -9.2102      1.00000
     35      -6.5665      1.00000
     36      -6.5634      1.00000
     37      -5.2259      1.00000
     38      -5.0896      1.00000
     39      -4.8780      1.00000
     40      -4.7070      1.00000
     41      -3.9200      1.00000
     42      -3.8865      1.00000
     43      -3.4497      1.00000
     44      -3.4007      1.00000
     45      -3.2918      1.00000
     46      -3.2400      1.00000
     47      -2.5776      1.00000
     48      -2.5548      1.00000
     49      -2.5334      1.00000
     50      -2.5098      1.00000
     51      -2.0228      1.00000
     52      -2.0020      1.00000
     53      -0.0217      0.00000
     54       0.0046      0.00000
     55       0.0875      0.00000
     56       0.0982      0.00000
     57       0.9891      0.00000
     58       1.0165      0.00000
     59       1.1582      0.00000
     60       1.1684      0.00000
     61       2.0279      0.00000
     62       2.0770      0.00000
     63       2.1888      0.00000
     64       2.3240      0.00000
     65       2.7291      0.00000
     66       2.7563      0.00000
     67       3.2706      0.00000
     68       3.2893      0.00000
     69       3.6322      0.00000
     70       3.6602      0.00000
     71       3.8744      0.00000
     72       3.9012      0.00000

 k-point    64 :       0.4558    0.0884    0.0000
  band No.  band energies     occupation 
      1     -36.3708      1.00000
      2     -36.3695      1.00000
      3     -36.2584      1.00000
      4     -36.2583      1.00000
      5     -23.9371      1.00000
      6     -23.9359      1.00000
      7     -23.9279      1.00000
      8     -23.9265      1.00000
      9     -22.9196      1.00000
     10     -22.9180      1.00000
     11     -22.8985      1.00000
     12     -22.8975      1.00000
     13     -22.8754      1.00000
     14     -22.8749      1.00000
     15     -19.3902      1.00000
     16     -19.3550      1.00000
     17     -19.2354      1.00000
     18     -19.2250      1.00000
     19     -18.3785      1.00000
     20     -18.3443      1.00000
     21     -18.2583      1.00000
     22     -18.1951      1.00000
     23     -18.0872      1.00000
     24     -18.0514      1.00000
     25     -17.9023      1.00000
     26     -17.8878      1.00000
     27     -14.3574      1.00000
     28     -14.3563      1.00000
     29     -14.0982      1.00000
     30     -14.0935      1.00000
     31     -12.8094      1.00000
     32     -12.7931      1.00000
     33      -9.2148      1.00000
     34      -9.2096      1.00000
     35      -6.5584      1.00000
     36      -6.5551      1.00000
     37      -5.2454      1.00000
     38      -5.0957      1.00000
     39      -4.9145      1.00000
     40      -4.7295      1.00000
     41      -3.9167      1.00000
     42      -3.8794      1.00000
     43      -3.4692      1.00000
     44      -3.4205      1.00000
     45      -3.2931      1.00000
     46      -3.2447      1.00000
     47      -2.5833      1.00000
     48      -2.5607      1.00000
     49      -2.5357      1.00000
     50      -2.5127      1.00000
     51      -1.9906      1.00000
     52      -1.9685      1.00000
     53      -0.0166      0.00000
     54       0.0104      0.00000
     55       0.1042      0.00000
     56       0.1148      0.00000
     57       0.9929      0.00000
     58       1.0201      0.00000
     59       1.1991      0.00000
     60       1.2115      0.00000
     61       2.0150      0.00000
     62       2.0713      0.00000
     63       2.1608      0.00000
     64       2.3078      0.00000
     65       2.7471      0.00000
     66       2.7783      0.00000
     67       3.2671      0.00000
     68       3.2864      0.00000
     69       3.6177      0.00000
     70       3.6448      0.00000
     71       3.8748      0.00000
     72       3.9019      0.00000

 k-point    65 :       0.4524    0.0952    0.0000
  band No.  band energies     occupation 
      1     -36.3707      1.00000
      2     -36.3694      1.00000
      3     -36.2584      1.00000
      4     -36.2582      1.00000
      5     -23.9371      1.00000
      6     -23.9358      1.00000
      7     -23.9280      1.00000
      8     -23.9265      1.00000
      9     -22.9195      1.00000
     10     -22.9178      1.00000
     11     -22.8986      1.00000
     12     -22.8975      1.00000
     13     -22.8755      1.00000
     14     -22.8750      1.00000
     15     -19.3912      1.00000
     16     -19.3535      1.00000
     17     -19.2356      1.00000
     18     -19.2244      1.00000
     19     -18.3803      1.00000
     20     -18.3442      1.00000
     21     -18.2603      1.00000
     22     -18.1932      1.00000
     23     -18.0894      1.00000
     24     -18.0512      1.00000
     25     -17.9045      1.00000
     26     -17.8886      1.00000
     27     -14.3534      1.00000
     28     -14.3522      1.00000
     29     -14.0969      1.00000
     30     -14.0919      1.00000
     31     -12.8091      1.00000
     32     -12.7917      1.00000
     33      -9.2146      1.00000
     34      -9.2090      1.00000
     35      -6.5498      1.00000
     36      -6.5462      1.00000
     37      -5.2667      1.00000
     38      -5.1046      1.00000
     39      -4.9498      1.00000
     40      -4.7522      1.00000
     41      -3.9136      1.00000
     42      -3.8719      1.00000
     43      -3.4905      1.00000
     44      -3.4421      1.00000
     45      -3.2927      1.00000
     46      -3.2482      1.00000
     47      -2.5893      1.00000
     48      -2.5673      1.00000
     49      -2.5376      1.00000
     50      -2.5156      1.00000
     51      -1.9578      1.00000
     52      -1.9343      1.00000
     53      -0.0113      0.00000
     54       0.0165      0.00000
     55       0.1220      0.00000
     56       0.1324      0.00000
     57       0.9968      0.00000
     58       1.0236      0.00000
     59       1.2415      0.00000
     60       1.2566      0.00000
     61       2.0004      0.00000
     62       2.0622      0.00000
     63       2.1366      0.00000
     64       2.2932      0.00000
     65       2.7653      0.00000
     66       2.8009      0.00000
     67       3.2640      0.00000
     68       3.2840      0.00000
     69       3.6024      0.00000
     70       3.6292      0.00000
     71       3.8720      0.00000
     72       3.9093      0.00000

 k-point    66 :       0.4490    0.1020    0.0000
  band No.  band energies     occupation 
      1     -36.3706      1.00000
      2     -36.3692      1.00000
      3     -36.2583      1.00000
      4     -36.2581      1.00000
      5     -23.9370      1.00000
      6     -23.9357      1.00000
      7     -23.9281      1.00000
      8     -23.9265      1.00000
      9     -22.9194      1.00000
     10     -22.9176      1.00000
     11     -22.8988      1.00000
     12     -22.8975      1.00000
     13     -22.8757      1.00000
     14     -22.8750      1.00000
     15     -19.3921      1.00000
     16     -19.3519      1.00000
     17     -19.2357      1.00000
     18     -19.2239      1.00000
     19     -18.3822      1.00000
     20     -18.3443      1.00000
     21     -18.2621      1.00000
     22     -18.1915      1.00000
     23     -18.0915      1.00000
     24     -18.0512      1.00000
     25     -17.9069      1.00000
     26     -17.8895      1.00000
     27     -14.3490      1.00000
     28     -14.3478      1.00000
     29     -14.0955      1.00000
     30     -14.0902      1.00000
     31     -12.8088      1.00000
     32     -12.7903      1.00000
     33      -9.2143      1.00000
     34      -9.2083      1.00000
     35      -6.5405      1.00000
     36      -6.5366      1.00000
     37      -5.2896      1.00000
     38      -5.1175      1.00000
     39      -4.9826      1.00000
     40      -4.7750      1.00000
     41      -3.9107      1.00000
     42      -3.8643      1.00000
     43      -3.5136      1.00000
     44      -3.4649      1.00000
     45      -3.2911      1.00000
     46      -3.2506      1.00000
     47      -2.5957      1.00000
     48      -2.5745      1.00000
     49      -2.5393      1.00000
     50      -2.5184      1.00000
     51      -1.9245      1.00000
     52      -1.8999      1.00000
     53      -0.0057      0.00000
     54       0.0229      0.00000
     55       0.1408      0.00000
     56       0.1511      0.00000
     57       1.0006      0.00000
     58       1.0271      0.00000
     59       1.2851      0.00000
     60       1.3032      0.00000
     61       1.9839      0.00000
     62       2.0468      0.00000
     63       2.1196      0.00000
     64       2.2809      0.00000
     65       2.7832      0.00000
     66       2.8237      0.00000
     67       3.2617      0.00000
     68       3.2824      0.00000
     69       3.5858      0.00000
     70       3.6131      0.00000
     71       3.8786      0.00000
     72       3.9130      0.00000

 k-point    67 :       0.4456    0.1088    0.0000
  band No.  band energies     occupation 
      1     -36.3705      1.00000
      2     -36.3691      1.00000
      3     -36.2583      1.00000
      4     -36.2581      1.00000
      5     -23.9370      1.00000
      6     -23.9356      1.00000
      7     -23.9282      1.00000
      8     -23.9265      1.00000
      9     -22.9192      1.00000
     10     -22.9174      1.00000
     11     -22.8989      1.00000
     12     -22.8976      1.00000
     13     -22.8758      1.00000
     14     -22.8751      1.00000
     15     -19.3930      1.00000
     16     -19.3504      1.00000
     17     -19.2358      1.00000
     18     -19.2234      1.00000
     19     -18.3841      1.00000
     20     -18.3446      1.00000
     21     -18.2637      1.00000
     22     -18.1898      1.00000
     23     -18.0937      1.00000
     24     -18.0511      1.00000
     25     -17.9093      1.00000
     26     -17.8904      1.00000
     27     -14.3445      1.00000
     28     -14.3432      1.00000
     29     -14.0941      1.00000
     30     -14.0884      1.00000
     31     -12.8085      1.00000
     32     -12.7889      1.00000
     33      -9.2141      1.00000
     34      -9.2078      1.00000
     35      -6.5306      1.00000
     36      -6.5265      1.00000
     37      -5.3141      1.00000
     38      -5.1359      1.00000
     39      -5.0111      1.00000
     40      -4.7977      1.00000
     41      -3.9083      1.00000
     42      -3.8564      1.00000
     43      -3.5378      1.00000
     44      -3.4880      1.00000
     45      -3.2886      1.00000
     46      -3.2519      1.00000
     47      -2.6024      1.00000
     48      -2.5820      1.00000
     49      -2.5409      1.00000
     50      -2.5211      1.00000
     51      -1.8910      1.00000
     52      -1.8654      1.00000
     53       0.0002      0.00000
     54       0.0295      0.00000
     55       0.1605      0.00000
     56       0.1708      0.00000
     57       1.0044      0.00000
     58       1.0305      0.00000
     59       1.3293      0.00000
     60       1.3507      0.00000
     61       1.9655      0.00000
     62       2.0244      0.00000
     63       2.1111      0.00000
     64       2.2715      0.00000
     65       2.8005      0.00000
     66       2.8463      0.00000
     67       3.2603      0.00000
     68       3.2820      0.00000
     69       3.5691      0.00000
     70       3.5956      0.00000
     71       3.8817      0.00000
     72       3.9097      0.00000

 k-point    68 :       0.4422    0.1156    0.0000
  band No.  band energies     occupation 
      1     -36.3703      1.00000
      2     -36.3689      1.00000
      3     -36.2582      1.00000
      4     -36.2580      1.00000
      5     -23.9370      1.00000
      6     -23.9355      1.00000
      7     -23.9283      1.00000
      8     -23.9265      1.00000
      9     -22.9191      1.00000
     10     -22.9172      1.00000
     11     -22.8990      1.00000
     12     -22.8976      1.00000
     13     -22.8759      1.00000
     14     -22.8752      1.00000
     15     -19.3938      1.00000
     16     -19.3488      1.00000
     17     -19.2359      1.00000
     18     -19.2228      1.00000
     19     -18.3861      1.00000
     20     -18.3452      1.00000
     21     -18.2650      1.00000
     22     -18.1883      1.00000
     23     -18.0958      1.00000
     24     -18.0512      1.00000
     25     -17.9119      1.00000
     26     -17.8913      1.00000
     27     -14.3396      1.00000
     28     -14.3383      1.00000
     29     -14.0926      1.00000
     30     -14.0866      1.00000
     31     -12.8080      1.00000
     32     -12.7874      1.00000
     33      -9.2139      1.00000
     34      -9.2072      1.00000
     35      -6.5201      1.00000
     36      -6.5157      1.00000
     37      -5.3402      1.00000
     38      -5.1608      1.00000
     39      -5.0344      1.00000
     40      -4.8203      1.00000
     41      -3.9064      1.00000
     42      -3.8485      1.00000
     43      -3.5630      1.00000
     44      -3.5110      1.00000
     45      -3.2853      1.00000
     46      -3.2522      1.00000
     47      -2.6093      1.00000
     48      -2.5899      1.00000
     49      -2.5425      1.00000
     50      -2.5238      1.00000
     51      -1.8576      1.00000
     52      -1.8311      1.00000
     53       0.0063      0.00000
     54       0.0363      0.00000
     55       0.1812      0.00000
     56       0.1913      0.00000
     57       1.0081      0.00000
     58       1.0339      0.00000
     59       1.3735      0.00000
     60       1.3985      0.00000
     61       1.9450      0.00000
     62       1.9978      0.00000
     63       2.1090      0.00000
     64       2.2653      0.00000
     65       2.8166      0.00000
     66       2.8680      0.00000
     67       3.2601      0.00000
     68       3.2830      0.00000
     69       3.5513      0.00000
     70       3.5777      0.00000
     71       3.8841      0.00000
     72       3.9133      0.00000

 k-point    69 :       0.4388    0.1224    0.0000
  band No.  band energies     occupation 
      1     -36.3702      1.00000
      2     -36.3688      1.00000
      3     -36.2581      1.00000
      4     -36.2580      1.00000
      5     -23.9369      1.00000
      6     -23.9354      1.00000
      7     -23.9284      1.00000
      8     -23.9265      1.00000
      9     -22.9190      1.00000
     10     -22.9169      1.00000
     11     -22.8992      1.00000
     12     -22.8977      1.00000
     13     -22.8760      1.00000
     14     -22.8753      1.00000
     15     -19.3947      1.00000
     16     -19.3473      1.00000
     17     -19.2360      1.00000
     18     -19.2223      1.00000
     19     -18.3880      1.00000
     20     -18.3460      1.00000
     21     -18.2661      1.00000
     22     -18.1868      1.00000
     23     -18.0978      1.00000
     24     -18.0513      1.00000
     25     -17.9145      1.00000
     26     -17.8922      1.00000
     27     -14.3346      1.00000
     28     -14.3332      1.00000
     29     -14.0911      1.00000
     30     -14.0848      1.00000
     31     -12.8076      1.00000
     32     -12.7860      1.00000
     33      -9.2138      1.00000
     34      -9.2067      1.00000
     35      -6.5091      1.00000
     36      -6.5044      1.00000
     37      -5.3676      1.00000
     38      -5.1916      1.00000
     39      -5.0527      1.00000
     40      -4.8429      1.00000
     41      -3.9052      1.00000
     42      -3.8404      1.00000
     43      -3.5888      1.00000
     44      -3.5335      1.00000
     45      -3.2813      1.00000
     46      -3.2516      1.00000
     47      -2.6166      1.00000
     48      -2.5980      1.00000
     49      -2.5441      1.00000
     50      -2.5264      1.00000
     51      -1.8245      1.00000
     52      -1.7972      1.00000
     53       0.0126      0.00000
     54       0.0434      0.00000
     55       0.2027      0.00000
     56       0.2127      0.00000
     57       1.0118      0.00000
     58       1.0373      0.00000
     59       1.4171      0.00000
     60       1.4460      0.00000
     61       1.9226      0.00000
     62       1.9697      0.00000
     63       2.1115      0.00000
     64       2.2628      0.00000
     65       2.8309      0.00000
     66       2.8882      0.00000
     67       3.2613      0.00000
     68       3.2856      0.00000
     69       3.5333      0.00000
     70       3.5597      0.00000
     71       3.8899      0.00000
     72       3.9118      0.00000

 k-point    70 :       0.4354    0.1293    0.0000
  band No.  band energies     occupation 
      1     -36.3700      1.00000
      2     -36.3687      1.00000
      3     -36.2581      1.00000
      4     -36.2579      1.00000
      5     -23.9369      1.00000
      6     -23.9353      1.00000
      7     -23.9285      1.00000
      8     -23.9265      1.00000
      9     -22.9188      1.00000
     10     -22.9167      1.00000
     11     -22.8994      1.00000
     12     -22.8977      1.00000
     13     -22.8761      1.00000
     14     -22.8754      1.00000
     15     -19.3955      1.00000
     16     -19.3458      1.00000
     17     -19.2361      1.00000
     18     -19.2218      1.00000
     19     -18.3900      1.00000
     20     -18.3470      1.00000
     21     -18.2670      1.00000
     22     -18.1855      1.00000
     23     -18.0999      1.00000
     24     -18.0514      1.00000
     25     -17.9173      1.00000
     26     -17.8932      1.00000
     27     -14.3293      1.00000
     28     -14.3279      1.00000
     29     -14.0895      1.00000
     30     -14.0830      1.00000
     31     -12.8071      1.00000
     32     -12.7845      1.00000
     33      -9.2137      1.00000
     34      -9.2062      1.00000
     35      -6.4975      1.00000
     36      -6.4925      1.00000
     37      -5.3962      1.00000
     38      -5.2266      1.00000
     39      -5.0676      1.00000
     40      -4.8653      1.00000
     41      -3.9050      1.00000
     42      -3.8323      1.00000
     43      -3.6149      1.00000
     44      -3.5548      1.00000
     45      -3.2768      1.00000
     46      -3.2501      1.00000
     47      -2.6241      1.00000
     48      -2.6065      1.00000
     49      -2.5457      1.00000
     50      -2.5290      1.00000
     51      -1.7919      1.00000
     52      -1.7639      1.00000
     53       0.0192      0.00000
     54       0.0507      0.00000
     55       0.2251      0.00000
     56       0.2350      0.00000
     57       1.0154      0.00000
     58       1.0406      0.00000
     59       1.4593      0.00000
     60       1.4922      0.00000
     61       1.8986      0.00000
     62       1.9417      0.00000
     63       2.1179      0.00000
     64       2.2644      0.00000
     65       2.8430      0.00000
     66       2.9061      0.00000
     67       3.2638      0.00000
     68       3.2894      0.00000
     69       3.5157      0.00000
     70       3.5425      0.00000
     71       3.8958      0.00000
     72       3.9210      0.00000

 k-point    71 :       0.4320    0.1361    0.0000
  band No.  band energies     occupation 
      1     -36.3699      1.00000
      2     -36.3685      1.00000
      3     -36.2580      1.00000
      4     -36.2578      1.00000
      5     -23.9368      1.00000
      6     -23.9352      1.00000
      7     -23.9286      1.00000
      8     -23.9265      1.00000
      9     -22.9186      1.00000
     10     -22.9165      1.00000
     11     -22.8995      1.00000
     12     -22.8978      1.00000
     13     -22.8763      1.00000
     14     -22.8755      1.00000
     15     -19.3962      1.00000
     16     -19.3443      1.00000
     17     -19.2361      1.00000
     18     -19.2213      1.00000
     19     -18.3919      1.00000
     20     -18.3482      1.00000
     21     -18.2677      1.00000
     22     -18.1843      1.00000
     23     -18.1019      1.00000
     24     -18.0515      1.00000
     25     -17.9201      1.00000
     26     -17.8942      1.00000
     27     -14.3237      1.00000
     28     -14.3223      1.00000
     29     -14.0880      1.00000
     30     -14.0812      1.00000
     31     -12.8065      1.00000
     32     -12.7830      1.00000
     33      -9.2137      1.00000
     34      -9.2059      1.00000
     35      -6.4853      1.00000
     36      -6.4800      1.00000
     37      -5.4258      1.00000
     38      -5.2642      1.00000
     39      -5.0808      1.00000
     40      -4.8878      1.00000
     41      -3.9058      1.00000
     42      -3.8243      1.00000
     43      -3.6410      1.00000
     44      -3.5748      1.00000
     45      -3.2717      1.00000
     46      -3.2477      1.00000
     47      -2.6319      1.00000
     48      -2.6152      1.00000
     49      -2.5474      1.00000
     50      -2.5316      1.00000
     51      -1.7599      1.00000
     52      -1.7315      0.99997
     53       0.0259      0.00000
     54       0.0582      0.00000
     55       0.2483      0.00000
     56       0.2580      0.00000
     57       1.0189      0.00000
     58       1.0438      0.00000
     59       1.4995      0.00000
     60       1.5362      0.00000
     61       1.8735      0.00000
     62       1.9149      0.00000
     63       2.1281      0.00000
     64       2.2702      0.00000
     65       2.8526      0.00000
     66       2.9211      0.00000
     67       3.2672      0.00000
     68       3.2936      0.00000
     69       3.4995      0.00000
     70       3.5271      0.00000
     71       3.9020      0.00000
     72       3.9230      0.00000

 k-point    72 :       0.4286    0.1429    0.0000
  band No.  band energies     occupation 
      1     -36.3697      1.00000
      2     -36.3683      1.00000
      3     -36.2579      1.00000
      4     -36.2578      1.00000
      5     -23.9367      1.00000
      6     -23.9351      1.00000
      7     -23.9288      1.00000
      8     -23.9265      1.00000
      9     -22.9184      1.00000
     10     -22.9162      1.00000
     11     -22.8997      1.00000
     12     -22.8979      1.00000
     13     -22.8764      1.00000
     14     -22.8756      1.00000
     15     -19.3970      1.00000
     16     -19.3429      1.00000
     17     -19.2361      1.00000
     18     -19.2208      1.00000
     19     -18.3939      1.00000
     20     -18.3497      1.00000
     21     -18.2680      1.00000
     22     -18.1833      1.00000
     23     -18.1038      1.00000
     24     -18.0516      1.00000
     25     -17.9231      1.00000
     26     -17.8952      1.00000
     27     -14.3180      1.00000
     28     -14.3165      1.00000
     29     -14.0865      1.00000
     30     -14.0794      1.00000
     31     -12.8060      1.00000
     32     -12.7815      1.00000
     33      -9.2137      1.00000
     34      -9.2055      1.00000
     35      -6.4726      1.00000
     36      -6.4670      1.00000
     37      -5.4562      1.00000
     38      -5.3031      1.00000
     39      -5.0934      1.00000
     40      -4.9104      1.00000
     41      -3.9077      1.00000
     42      -3.8164      1.00000
     43      -3.6668      1.00000
     44      -3.5929      1.00000
     45      -3.2661      1.00000
     46      -3.2446      1.00000
     47      -2.6399      1.00000
     48      -2.6242      1.00000
     49      -2.5490      1.00000
     50      -2.5341      1.00000
     51      -1.7288      0.99996
     52      -1.7000      0.99918
     53       0.0328      0.00000
     54       0.0659      0.00000
     55       0.2722      0.00000
     56       0.2818      0.00000
     57       1.0222      0.00000
     58       1.0469      0.00000
     59       1.5367      0.00000
     60       1.5767      0.00000
     61       1.8482      0.00000
     62       1.8898      0.00000
     63       2.1425      0.00000
     64       2.2806      0.00000
     65       2.8594      0.00000
     66       2.9329      0.00000
     67       3.2701      0.00000
     68       3.2964      0.00000
     69       3.4867      0.00000
     70       3.5147      0.00000
     71       3.9100      0.00000
     72       3.9287      0.00000

 k-point    73 :       0.4252    0.1497    0.0000
  band No.  band energies     occupation 
      1     -36.3695      1.00000
      2     -36.3682      1.00000
      3     -36.2579      1.00000
      4     -36.2577      1.00000
      5     -23.9367      1.00000
      6     -23.9349      1.00000
      7     -23.9289      1.00000
      8     -23.9265      1.00000
      9     -22.9182      1.00000
     10     -22.9160      1.00000
     11     -22.8999      1.00000
     12     -22.8979      1.00000
     13     -22.8765      1.00000
     14     -22.8757      1.00000
     15     -19.3977      1.00000
     16     -19.3415      1.00000
     17     -19.2361      1.00000
     18     -19.2204      1.00000
     19     -18.3958      1.00000
     20     -18.3513      1.00000
     21     -18.2682      1.00000
     22     -18.1824      1.00000
     23     -18.1057      1.00000
     24     -18.0517      1.00000
     25     -17.9261      1.00000
     26     -17.8962      1.00000
     27     -14.3121      1.00000
     28     -14.3106      1.00000
     29     -14.0849      1.00000
     30     -14.0776      1.00000
     31     -12.8054      1.00000
     32     -12.7800      1.00000
     33      -9.2139      1.00000
     34      -9.2053      1.00000
     35      -6.4593      1.00000
     36      -6.4535      1.00000
     37      -5.4871      1.00000
     38      -5.3426      1.00000
     39      -5.1059      1.00000
     40      -4.9333      1.00000
     41      -3.9109      1.00000
     42      -3.8087      1.00000
     43      -3.6920      1.00000
     44      -3.6091      1.00000
     45      -3.2599      1.00000
     46      -3.2407      1.00000
     47      -2.6482      1.00000
     48      -2.6334      1.00000
     49      -2.5508      1.00000
     50      -2.5366      1.00000
     51      -1.6986      0.99907
     52      -1.6696      0.98898
     53       0.0399      0.00000
     54       0.0738      0.00000
     55       0.2967      0.00000
     56       0.3062      0.00000
     57       1.0254      0.00000
     58       1.0498      0.00000
     59       1.5699      0.00000
     60       1.6120      0.00000
     61       1.8240      0.00000
     62       1.8671      0.00000
     63       2.1616      0.00000
     64       2.2955      0.00000
     65       2.8634      0.00000
     66       2.9412      0.00000
     67       3.2707      0.00000
     68       3.2953      0.00000
     69       3.4796      0.00000
     70       3.5075      0.00000
     71       3.9190      0.00000
     72       3.9376      0.00000

 k-point    74 :       0.4218    0.1565    0.0000
  band No.  band energies     occupation 
      1     -36.3694      1.00000
      2     -36.3680      1.00000
      3     -36.2578      1.00000
      4     -36.2576      1.00000
      5     -23.9366      1.00000
      6     -23.9348      1.00000
      7     -23.9290      1.00000
      8     -23.9265      1.00000
      9     -22.9180      1.00000
     10     -22.9157      1.00000
     11     -22.9001      1.00000
     12     -22.8980      1.00000
     13     -22.8766      1.00000
     14     -22.8758      1.00000
     15     -19.3984      1.00000
     16     -19.3401      1.00000
     17     -19.2361      1.00000
     18     -19.2200      1.00000
     19     -18.3978      1.00000
     20     -18.3532      1.00000
     21     -18.2681      1.00000
     22     -18.1816      1.00000
     23     -18.1076      1.00000
     24     -18.0518      1.00000
     25     -17.9292      1.00000
     26     -17.8972      1.00000
     27     -14.3059      1.00000
     28     -14.3044      1.00000
     29     -14.0835      1.00000
     30     -14.0759      1.00000
     31     -12.8048      1.00000
     32     -12.7785      1.00000
     33      -9.2141      1.00000
     34      -9.2052      1.00000
     35      -6.4456      1.00000
     36      -6.4395      1.00000
     37      -5.5184      1.00000
     38      -5.3820      1.00000
     39      -5.1190      1.00000
     40      -4.9565      1.00000
     41      -3.9154      1.00000
     42      -3.8014      1.00000
     43      -3.7163      1.00000
     44      -3.6231      1.00000
     45      -3.2532      1.00000
     46      -3.2360      1.00000
     47      -2.6568      1.00000
     48      -2.6429      1.00000
     49      -2.5525      1.00000
     50      -2.5391      1.00000
     51      -1.6696      0.98894
     52      -1.6405      0.92861
     53       0.0471      0.00000
     54       0.0818      0.00000
     55       0.3218      0.00000
     56       0.3312      0.00000
     57       1.0284      0.00000
     58       1.0526      0.00000
     59       1.5981      0.00000
     60       1.6400      0.00000
     61       1.8029      0.00000
     62       1.8475      0.00000
     63       2.1857      0.00000
     64       2.3151      0.00000
     65       2.8647      0.00000
     66       2.9462      0.00000
     67       3.2665      0.00000
     68       3.2878      0.00000
     69       3.4802      0.00000
     70       3.5075      0.00000
     71       3.9274      0.00000
     72       3.9559      0.00000

 k-point    75 :       0.4184    0.1633    0.0000
  band No.  band energies     occupation 
      1     -36.3692      1.00000
      2     -36.3678      1.00000
      3     -36.2577      1.00000
      4     -36.2575      1.00000
      5     -23.9365      1.00000
      6     -23.9347      1.00000
      7     -23.9291      1.00000
      8     -23.9265      1.00000
      9     -22.9178      1.00000
     10     -22.9155      1.00000
     11     -22.9003      1.00000
     12     -22.8981      1.00000
     13     -22.8767      1.00000
     14     -22.8759      1.00000
     15     -19.3991      1.00000
     16     -19.3388      1.00000
     17     -19.2360      1.00000
     18     -19.2195      1.00000
     19     -18.3998      1.00000
     20     -18.3552      1.00000
     21     -18.2678      1.00000
     22     -18.1810      1.00000
     23     -18.1094      1.00000
     24     -18.0518      1.00000
     25     -17.9323      1.00000
     26     -17.8982      1.00000
     27     -14.2996      1.00000
     28     -14.2981      1.00000
     29     -14.0820      1.00000
     30     -14.0742      1.00000
     31     -12.8041      1.00000
     32     -12.7770      1.00000
     33      -9.2144      1.00000
     34      -9.2051      1.00000
     35      -6.4314      1.00000
     36      -6.4250      1.00000
     37      -5.5497      1.00000
     38      -5.4211      1.00000
     39      -5.1328      1.00000
     40      -4.9801      1.00000
     41      -3.9210      1.00000
     42      -3.7947      1.00000
     43      -3.7393      1.00000
     44      -3.6350      1.00000
     45      -3.2459      1.00000
     46      -3.2306      1.00000
     47      -2.6657      1.00000
     48      -2.6526      1.00000
     49      -2.5543      1.00000
     50      -2.5416      1.00000
     51      -1.6417      0.93331
     52      -1.6127      0.75163
     53       0.0544      0.00000
     54       0.0899      0.00000
     55       0.3474      0.00000
     56       0.3567      0.00000
     57       1.0312      0.00000
     58       1.0552      0.00000
     59       1.6199      0.00000
     60       1.6574      0.00000
     61       1.7879      0.00000
     62       1.8324      0.00000
     63       2.2149      0.00000
     64       2.3391      0.00000
     65       2.8637      0.00000
     66       2.9484      0.00000
     67       3.2560      0.00000
     68       3.2731      0.00000
     69       3.4890      0.00000
     70       3.5155      0.00000
     71       3.9316      0.00000
     72       3.9628      0.00000

 k-point    76 :       0.4150    0.1701    0.0000
  band No.  band energies     occupation 
      1     -36.3690      1.00000
      2     -36.3677      1.00000
      3     -36.2576      1.00000
      4     -36.2575      1.00000
      5     -23.9365      1.00000
      6     -23.9346      1.00000
      7     -23.9293      1.00000
      8     -23.9266      1.00000
      9     -22.9176      1.00000
     10     -22.9152      1.00000
     11     -22.9006      1.00000
     12     -22.8982      1.00000
     13     -22.8768      1.00000
     14     -22.8760      1.00000
     15     -19.3997      1.00000
     16     -19.3375      1.00000
     17     -19.2360      1.00000
     18     -19.2192      1.00000
     19     -18.4017      1.00000
     20     -18.3574      1.00000
     21     -18.2673      1.00000
     22     -18.1805      1.00000
     23     -18.1111      1.00000
     24     -18.0518      1.00000
     25     -17.9356      1.00000
     26     -17.8992      1.00000
     27     -14.2932      1.00000
     28     -14.2917      1.00000
     29     -14.0807      1.00000
     30     -14.0726      1.00000
     31     -12.8035      1.00000
     32     -12.7756      1.00000
     33      -9.2148      1.00000
     34      -9.2052      1.00000
     35      -6.4168      1.00000
     36      -6.4101      1.00000
     37      -5.5809      1.00000
     38      -5.4595      1.00000
     39      -5.1476      1.00000
     40      -5.0044      1.00000
     41      -3.9275      1.00000
     42      -3.7900      1.00000
     43      -3.7596      1.00000
     44      -3.6448      1.00000
     45      -3.2380      1.00000
     46      -3.2244      1.00000
     47      -2.6747      1.00000
     48      -2.6626      1.00000
     49      -2.5562      1.00000
     50      -2.5441      1.00000
     51      -1.6152      0.77355
     52      -1.5863      0.47385
     53       0.0617      0.00000
     54       0.0982      0.00000
     55       0.3734      0.00000
     56       0.3827      0.00000
     57       1.0338      0.00000
     58       1.0576      0.00000
     59       1.6335      0.00000
     60       1.6617      0.00000
     61       1.7816      0.00000
     62       1.8234      0.00000
     63       2.2491      0.00000
     64       2.3672      0.00000
     65       2.8607      0.00000
     66       2.9482      0.00000
     67       3.2390      0.00000
     68       3.2523      0.00000
     69       3.5042      0.00000
     70       3.5309      0.00000
     71       3.9433      0.00000
     72       3.9803      0.00000

 k-point    77 :       0.4116    0.1769    0.0000
  band No.  band energies     occupation 
      1     -36.3689      1.00000
      2     -36.3675      1.00000
      3     -36.2576      1.00000
      4     -36.2574      1.00000
      5     -23.9364      1.00000
      6     -23.9345      1.00000
      7     -23.9294      1.00000
      8     -23.9266      1.00000
      9     -22.9174      1.00000
     10     -22.9150      1.00000
     11     -22.9008      1.00000
     12     -22.8983      1.00000
     13     -22.8769      1.00000
     14     -22.8761      1.00000
     15     -19.4003      1.00000
     16     -19.3363      1.00000
     17     -19.2359      1.00000
     18     -19.2188      1.00000
     19     -18.4036      1.00000
     20     -18.3597      1.00000
     21     -18.2666      1.00000
     22     -18.1802      1.00000
     23     -18.1128      1.00000
     24     -18.0517      1.00000
     25     -17.9388      1.00000
     26     -17.9002      1.00000
     27     -14.2865      1.00000
     28     -14.2851      1.00000
     29     -14.0794      1.00000
     30     -14.0710      1.00000
     31     -12.8028      1.00000
     32     -12.7741      1.00000
     33      -9.2153      1.00000
     34      -9.2054      1.00000
     35      -6.4018      1.00000
     36      -6.3948      1.00000
     37      -5.6118      1.00000
     38      -5.4971      1.00000
     39      -5.1634      1.00000
     40      -5.0293      1.00000
     41      -3.9348      1.00000
     42      -3.7936      1.00000
     43      -3.7706      1.00000
     44      -3.6527      1.00000
     45      -3.2296      1.00000
     46      -3.2175      1.00000
     47      -2.6841      1.00000
     48      -2.6728      1.00000
     49      -2.5580      1.00000
     50      -2.5466      1.00000
     51      -1.5901      0.51570
     52      -1.5615      0.22119
     53       0.0692      0.00000
     54       0.1065      0.00000
     55       0.3998      0.00000
     56       0.4090      0.00000
     57       1.0362      0.00000
     58       1.0598      0.00000
     59       1.6371      0.00000
     60       1.6553      0.00000
     61       1.7832      0.00000
     62       1.8217      0.00000
     63       2.2879      0.00000
     64       2.3989      0.00000
     65       2.8562      0.00000
     66       2.9463      0.00000
     67       3.2163      0.00000
     68       3.2270      0.00000
     69       3.5235      0.00000
     70       3.5516      0.00000
     71       3.9671      0.00000
     72       4.0081      0.00000

 k-point    78 :       0.4082    0.1837    0.0000
  band No.  band energies     occupation 
      1     -36.3687      1.00000
      2     -36.3673      1.00000
      3     -36.2575      1.00000
      4     -36.2573      1.00000
      5     -23.9363      1.00000
      6     -23.9344      1.00000
      7     -23.9295      1.00000
      8     -23.9266      1.00000
      9     -22.9171      1.00000
     10     -22.9147      1.00000
     11     -22.9010      1.00000
     12     -22.8984      1.00000
     13     -22.8770      1.00000
     14     -22.8762      1.00000
     15     -19.4009      1.00000
     16     -19.3351      1.00000
     17     -19.2358      1.00000
     18     -19.2185      1.00000
     19     -18.4055      1.00000
     20     -18.3621      1.00000
     21     -18.2657      1.00000
     22     -18.1800      1.00000
     23     -18.1145      1.00000
     24     -18.0515      1.00000
     25     -17.9422      1.00000
     26     -17.9012      1.00000
     27     -14.2798      1.00000
     28     -14.2783      1.00000
     29     -14.0782      1.00000
     30     -14.0696      1.00000
     31     -12.8022      1.00000
     32     -12.7727      1.00000
     33      -9.2159      1.00000
     34      -9.2057      1.00000
     35      -6.3864      1.00000
     36      -6.3791      1.00000
     37      -5.6421      1.00000
     38      -5.5336      1.00000
     39      -5.1803      1.00000
     40      -5.0549      1.00000
     41      -3.9424      1.00000
     42      -3.8090      1.00000
     43      -3.7688      1.00000
     44      -3.6590      1.00000
     45      -3.2207      1.00000
     46      -3.2098      1.00000
     47      -2.6937      1.00000
     48      -2.6832      1.00000
     49      -2.5599      1.00000
     50      -2.5490      1.00000
     51      -1.5664      0.26400
     52      -1.5382      0.07685
     53       0.0766      0.00000
     54       0.1149      0.00000
     55       0.4263      0.00000
     56       0.4355      0.00000
     57       1.0385      0.00000
     58       1.0618      0.00000
     59       1.6289      0.00000
     60       1.6456      0.00000
     61       1.7891      0.00000
     62       1.8261      0.00000
     63       2.3302      0.00000
     64       2.4333      0.00000
     65       2.8506      0.00000
     66       2.9434      0.00000
     67       3.1893      0.00000
     68       3.1987      0.00000
     69       3.5444      0.00000
     70       3.5752      0.00000
     71       3.9722      0.00000
     72       4.0219      0.00000

 k-point    79 :       0.4048    0.1905    0.0000
  band No.  band energies     occupation 
      1     -36.3685      1.00000
      2     -36.3671      1.00000
      3     -36.2574      1.00000
      4     -36.2573      1.00000
      5     -23.9362      1.00000
      6     -23.9343      1.00000
      7     -23.9296      1.00000
      8     -23.9266      1.00000
      9     -22.9169      1.00000
     10     -22.9144      1.00000
     11     -22.9013      1.00000
     12     -22.8985      1.00000
     13     -22.8771      1.00000
     14     -22.8763      1.00000
     15     -19.4015      1.00000
     16     -19.3340      1.00000
     17     -19.2357      1.00000
     18     -19.2182      1.00000
     19     -18.4074      1.00000
     20     -18.3646      1.00000
     21     -18.2647      1.00000
     22     -18.1800      1.00000
     23     -18.1161      1.00000
     24     -18.0512      1.00000
     25     -17.9455      1.00000
     26     -17.9021      1.00000
     27     -14.2729      1.00000
     28     -14.2715      1.00000
     29     -14.0771      1.00000
     30     -14.0683      1.00000
     31     -12.8015      1.00000
     32     -12.7713      1.00000
     33      -9.2166      1.00000
     34      -9.2061      1.00000
     35      -6.3708      1.00000
     36      -6.3632      1.00000
     37      -5.6716      1.00000
     38      -5.5688      1.00000
     39      -5.1984      1.00000
     40      -5.0812      1.00000
     41      -3.9502      1.00000
     42      -3.8262      1.00000
     43      -3.7641      1.00000
     44      -3.6640      1.00000
     45      -3.2113      1.00000
     46      -3.2014      1.00000
     47      -2.7035      1.00000
     48      -2.6939      1.00000
     49      -2.5619      1.00000
     50      -2.5515      1.00000
     51      -1.5441      0.10391
     52      -1.5165      0.02068
     53       0.0841      0.00000
     54       0.1233      0.00000
     55       0.4528      0.00000
     56       0.4622      0.00000
     57       1.0405      0.00000
     58       1.0636      0.00000
     59       1.6125      0.00000
     60       1.6352      0.00000
     61       1.7969      0.00000
     62       1.8340      0.00000
     63       2.3752      0.00000
     64       2.4695      0.00000
     65       2.8445      0.00000
     66       2.9401      0.00000
     67       3.1592      0.00000
     68       3.1682      0.00000
     69       3.5651      0.00000
     70       3.5998      0.00000
     71       3.9965      0.00000
     72       4.0411      0.00000

 k-point    80 :       0.4014    0.1973    0.0000
  band No.  band energies     occupation 
      1     -36.3683      1.00000
      2     -36.3670      1.00000
      3     -36.2574      1.00000
      4     -36.2572      1.00000
      5     -23.9361      1.00000
      6     -23.9342      1.00000
      7     -23.9298      1.00000
      8     -23.9266      1.00000
      9     -22.9166      1.00000
     10     -22.9142      1.00000
     11     -22.9015      1.00000
     12     -22.8986      1.00000
     13     -22.8772      1.00000
     14     -22.8764      1.00000
     15     -19.4020      1.00000
     16     -19.3329      1.00000
     17     -19.2355      1.00000
     18     -19.2179      1.00000
     19     -18.4092      1.00000
     20     -18.3672      1.00000
     21     -18.2635      1.00000
     22     -18.1801      1.00000
     23     -18.1176      1.00000
     24     -18.0508      1.00000
     25     -17.9489      1.00000
     26     -17.9030      1.00000
     27     -14.2659      1.00000
     28     -14.2645      1.00000
     29     -14.0762      1.00000
     30     -14.0671      1.00000
     31     -12.8008      1.00000
     32     -12.7700      1.00000
     33      -9.2175      1.00000
     34      -9.2067      1.00000
     35      -6.3549      1.00000
     36      -6.3470      1.00000
     37      -5.7001      1.00000
     38      -5.6026      1.00000
     39      -5.2176      1.00000
     40      -5.1083      1.00000
     41      -3.9578      1.00000
     42      -3.8426      1.00000
     43      -3.7591      1.00000
     44      -3.6679      1.00000
     45      -3.2014      1.00000
     46      -3.1923      1.00000
     47      -2.7136      1.00000
     48      -2.7047      1.00000
     49      -2.5638      1.00000
     50      -2.5539      1.00000
     51      -1.5234      0.03249
     52      -1.4965      0.00456
     53       0.0915      0.00000
     54       0.1317      0.00000
     55       0.4793      0.00000
     56       0.4888      0.00000
     57       1.0424      0.00000
     58       1.0653      0.00000
     59       1.5936      0.00000
     60       1.6231      0.00000
     61       1.8054      0.00000
     62       1.8431      0.00000
     63       2.4216      0.00000
     64       2.5064      0.00000
     65       2.8384      0.00000
     66       2.9373      0.00000
     67       3.1271      0.00000
     68       3.1363      0.00000
     69       3.5839      0.00000
     70       3.6235      0.00000
     71       4.0159      0.00000
     72       4.0693      0.00000

 k-point    81 :       0.3980    0.2041    0.0000
  band No.  band energies     occupation 
      1     -36.3682      1.00000
      2     -36.3668      1.00000
      3     -36.2573      1.00000
      4     -36.2571      1.00000
      5     -23.9360      1.00000
      6     -23.9341      1.00000
      7     -23.9299      1.00000
      8     -23.9266      1.00000
      9     -22.9164      1.00000
     10     -22.9139      1.00000
     11     -22.9018      1.00000
     12     -22.8987      1.00000
     13     -22.8773      1.00000
     14     -22.8765      1.00000
     15     -19.4025      1.00000
     16     -19.3319      1.00000
     17     -19.2354      1.00000
     18     -19.2176      1.00000
     19     -18.4110      1.00000
     20     -18.3697      1.00000
     21     -18.2623      1.00000
     22     -18.1804      1.00000
     23     -18.1191      1.00000
     24     -18.0502      1.00000
     25     -17.9524      1.00000
     26     -17.9039      1.00000
     27     -14.2589      1.00000
     28     -14.2575      1.00000
     29     -14.0754      1.00000
     30     -14.0661      1.00000
     31     -12.8001      1.00000
     32     -12.7687      1.00000
     33      -9.2184      1.00000
     34      -9.2074      1.00000
     35      -6.3388      1.00000
     36      -6.3306      1.00000
     37      -5.7275      1.00000
     38      -5.6349      1.00000
     39      -5.2379      1.00000
     40      -5.1361      1.00000
     41      -3.9650      1.00000
     42      -3.8577      1.00000
     43      -3.7544      1.00000
     44      -3.6711      1.00000
     45      -3.1911      1.00000
     46      -3.1825      1.00000
     47      -2.7238      1.00000
     48      -2.7158      1.00000
     49      -2.5657      1.00000
     50      -2.5563      1.00000
     51      -1.5042      0.00847
     52      -1.4780      0.00088
     53       0.0989      0.00000
     54       0.1400      0.00000
     55       0.5055      0.00000
     56       0.5152      0.00000
     57       1.0442      0.00000
     58       1.0669      0.00000
     59       1.5745      0.00000
     60       1.6100      0.00000
     61       1.8139      0.00000
     62       1.8524      0.00000
     63       2.4681      0.00000
     64       2.5427      0.00000
     65       2.8333      0.00000
     66       2.9357      0.00000
     67       3.0937      0.00000
     68       3.1034      0.00000
     69       3.5997      0.00000
     70       3.6448      0.00000
     71       4.0459      0.00000
     72       4.0999      0.00000

 k-point    82 :       0.3946    0.2109    0.0000
  band No.  band energies     occupation 
      1     -36.3680      1.00000
      2     -36.3666      1.00000
      3     -36.2572      1.00000
      4     -36.2570      1.00000
      5     -23.9359      1.00000
      6     -23.9340      1.00000
      7     -23.9300      1.00000
      8     -23.9266      1.00000
      9     -22.9161      1.00000
     10     -22.9137      1.00000
     11     -22.9020      1.00000
     12     -22.8988      1.00000
     13     -22.8774      1.00000
     14     -22.8766      1.00000
     15     -19.4030      1.00000
     16     -19.3310      1.00000
     17     -19.2352      1.00000
     18     -19.2174      1.00000
     19     -18.4128      1.00000
     20     -18.3723      1.00000
     21     -18.2609      1.00000
     22     -18.1808      1.00000
     23     -18.1206      1.00000
     24     -18.0495      1.00000
     25     -17.9558      1.00000
     26     -17.9047      1.00000
     27     -14.2517      1.00000
     28     -14.2504      1.00000
     29     -14.0748      1.00000
     30     -14.0652      1.00000
     31     -12.7995      1.00000
     32     -12.7674      1.00000
     33      -9.2195      1.00000
     34      -9.2082      1.00000
     35      -6.3226      1.00000
     36      -6.3142      1.00000
     37      -5.7535      1.00000
     38      -5.6655      1.00000
     39      -5.2593      1.00000
     40      -5.1646      1.00000
     41      -3.9716      1.00000
     42      -3.8711      1.00000
     43      -3.7501      1.00000
     44      -3.6736      1.00000
     45      -3.1803      1.00000
     46      -3.1721      1.00000
     47      -2.7343      1.00000
     48      -2.7270      1.00000
     49      -2.5676      1.00000
     50      -2.5586      1.00000
     51      -1.4866      0.00194
     52      -1.4612      0.00016
     53       0.1062      0.00000
     54       0.1483      0.00000
     55       0.5313      0.00000
     56       0.5413      0.00000
     57       1.0459      0.00000
     58       1.0685      0.00000
     59       1.5560      0.00000
     60       1.5967      0.00000
     61       1.8220      0.00000
     62       1.8614      0.00000
     63       2.5131      0.00000
     64       2.5768      0.00000
     65       2.8299      0.00000
     66       2.9360      0.00000
     67       3.0600      0.00000
     68       3.0700      0.00000
     69       3.6123      0.00000
     70       3.6633      0.00000
     71       4.0938      0.00000
     72       4.1617      0.00000

 k-point    83 :       0.3912    0.2177    0.0000
  band No.  band energies     occupation 
      1     -36.3678      1.00000
      2     -36.3665      1.00000
      3     -36.2571      1.00000
      4     -36.2570      1.00000
      5     -23.9358      1.00000
      6     -23.9340      1.00000
      7     -23.9302      1.00000
      8     -23.9266      1.00000
      9     -22.9159      1.00000
     10     -22.9134      1.00000
     11     -22.9023      1.00000
     12     -22.8989      1.00000
     13     -22.8774      1.00000
     14     -22.8767      1.00000
     15     -19.4035      1.00000
     16     -19.3301      1.00000
     17     -19.2351      1.00000
     18     -19.2173      1.00000
     19     -18.4145      1.00000
     20     -18.3748      1.00000
     21     -18.2594      1.00000
     22     -18.1813      1.00000
     23     -18.1221      1.00000
     24     -18.0487      1.00000
     25     -17.9593      1.00000
     26     -17.9055      1.00000
     27     -14.2445      1.00000
     28     -14.2432      1.00000
     29     -14.0743      1.00000
     30     -14.0645      1.00000
     31     -12.7988      1.00000
     32     -12.7662      1.00000
     33      -9.2207      1.00000
     34      -9.2091      1.00000
     35      -6.3065      1.00000
     36      -6.2979      1.00000
     37      -5.7778      1.00000
     38      -5.6942      1.00000
     39      -5.2818      1.00000
     40      -5.1937      1.00000
     41      -3.9774      1.00000
     42      -3.8830      1.00000
     43      -3.7464      1.00000
     44      -3.6758      1.00000
     45      -3.1692      1.00000
     46      -3.1610      1.00000
     47      -2.7449      1.00000
     48      -2.7384      1.00000
     49      -2.5696      1.00000
     50      -2.5609      1.00000
     51      -1.4704      0.00041
     52      -1.4460      0.00003
     53       0.1134      0.00000
     54       0.1566      0.00000
     55       0.5565      0.00000
     56       0.5667      0.00000
     57       1.0475      0.00000
     58       1.0701      0.00000
     59       1.5387      0.00000
     60       1.5840      0.00000
     61       1.8295      0.00000
     62       1.8699      0.00000
     63       2.5547      0.00000
     64       2.6072      0.00000
     65       2.8298      0.00000
     66       2.9386      0.00000
     67       3.0269      0.00000
     68       3.0370      0.00000
     69       3.6198      0.00000
     70       3.6774      0.00000
     71       4.1371      0.00000
     72       4.1762      0.00000

 k-point    84 :       0.3878    0.2245    0.0000
  band No.  band energies     occupation 
      1     -36.3677      1.00000
      2     -36.3663      1.00000
      3     -36.2571      1.00000
      4     -36.2569      1.00000
      5     -23.9357      1.00000
      6     -23.9339      1.00000
      7     -23.9303      1.00000
      8     -23.9267      1.00000
      9     -22.9156      1.00000
     10     -22.9132      1.00000
     11     -22.9026      1.00000
     12     -22.8990      1.00000
     13     -22.8775      1.00000
     14     -22.8768      1.00000
     15     -19.4039      1.00000
     16     -19.3293      1.00000
     17     -19.2349      1.00000
     18     -19.2171      1.00000
     19     -18.4161      1.00000
     20     -18.3773      1.00000
     21     -18.2579      1.00000
     22     -18.1820      1.00000
     23     -18.1235      1.00000
     24     -18.0477      1.00000
     25     -17.9628      1.00000
     26     -17.9063      1.00000
     27     -14.2373      1.00000
     28     -14.2360      1.00000
     29     -14.0741      1.00000
     30     -14.0640      1.00000
     31     -12.7982      1.00000
     32     -12.7650      1.00000
     33      -9.2220      1.00000
     34      -9.2101      1.00000
     35      -6.2905      1.00000
     36      -6.2818      1.00000
     37      -5.8004      1.00000
     38      -5.7209      1.00000
     39      -5.3051      1.00000
     40      -5.2234      1.00000
     41      -3.9824      1.00000
     42      -3.8932      1.00000
     43      -3.7431      1.00000
     44      -3.6778      1.00000
     45      -3.1578      1.00000
     46      -3.1493      1.00000
     47      -2.7557      1.00000
     48      -2.7499      1.00000
     49      -2.5715      1.00000
     50      -2.5632      1.00000
     51      -1.4557      0.00008
     52      -1.4323      0.00000
     53       0.1205      0.00000
     54       0.1647      0.00000
     55       0.5809      0.00000
     56       0.5914      0.00000
     57       1.0492      0.00000
     58       1.0719      0.00000
     59       1.5228      0.00000
     60       1.5723      0.00000
     61       1.8364      0.00000
     62       1.8780      0.00000
     63       2.5904      0.00000
     64       2.6326      0.00000
     65       2.8347      0.00000
     66       2.9410      0.00000
     67       2.9966      0.00000
     68       3.0068      0.00000
     69       3.6241      0.00000
     70       3.6877      0.00000
     71       4.1739      0.00000
     72       4.2022      0.00000

 k-point    85 :       0.3844    0.2313    0.0000
  band No.  band energies     occupation 
      1     -36.3675      1.00000
      2     -36.3662      1.00000
      3     -36.2570      1.00000
      4     -36.2568      1.00000
      5     -23.9356      1.00000
      6     -23.9338      1.00000
      7     -23.9304      1.00000
      8     -23.9267      1.00000
      9     -22.9154      1.00000
     10     -22.9130      1.00000
     11     -22.9029      1.00000
     12     -22.8991      1.00000
     13     -22.8775      1.00000
     14     -22.8769      1.00000
     15     -19.4043      1.00000
     16     -19.3285      1.00000
     17     -19.2347      1.00000
     18     -19.2170      1.00000
     19     -18.4177      1.00000
     20     -18.3797      1.00000
     21     -18.2563      1.00000
     22     -18.1827      1.00000
     23     -18.1248      1.00000
     24     -18.0466      1.00000
     25     -17.9663      1.00000
     26     -17.9070      1.00000
     27     -14.2301      1.00000
     28     -14.2288      1.00000
     29     -14.0741      1.00000
     30     -14.0637      1.00000
     31     -12.7975      1.00000
     32     -12.7638      1.00000
     33      -9.2234      1.00000
     34      -9.2112      1.00000
     35      -6.2749      1.00000
     36      -6.2660      1.00000
     37      -5.8209      1.00000
     38      -5.7453      1.00000
     39      -5.3293      1.00000
     40      -5.2536      1.00000
     41      -3.9865      1.00000
     42      -3.9019      1.00000
     43      -3.7404      1.00000
     44      -3.6797      1.00000
     45      -3.1460      1.00000
     46      -3.1372      1.00000
     47      -2.7666      1.00000
     48      -2.7616      1.00000
     49      -2.5733      1.00000
     50      -2.5654      1.00000
     51      -1.4424      0.00002
     52      -1.4201      0.00000
     53       0.1274      0.00000
     54       0.1726      0.00000
     55       0.6041      0.00000
     56       0.6152      0.00000
     57       1.0509      0.00000
     58       1.0740      0.00000
     59       1.5083      0.00000
     60       1.5619      0.00000
     61       1.8426      0.00000
     62       1.8858      0.00000
     63       2.6174      0.00000
     64       2.6522      0.00000
     65       2.8460      0.00000
     66       2.9317      0.00000
     67       2.9682      0.00000
     68       2.9939      0.00000
     69       3.6250      0.00000
     70       3.6940      0.00000
     71       4.2178      0.00000
     72       4.2410      0.00000

 k-point    86 :       0.3810    0.2381    0.0000
  band No.  band energies     occupation 
      1     -36.3674      1.00000
      2     -36.3660      1.00000
      3     -36.2569      1.00000
      4     -36.2568      1.00000
      5     -23.9355      1.00000
      6     -23.9338      1.00000
      7     -23.9305      1.00000
      8     -23.9267      1.00000
      9     -22.9151      1.00000
     10     -22.9127      1.00000
     11     -22.9032      1.00000
     12     -22.8992      1.00000
     13     -22.8776      1.00000
     14     -22.8770      1.00000
     15     -19.4047      1.00000
     16     -19.3278      1.00000
     17     -19.2345      1.00000
     18     -19.2169      1.00000
     19     -18.4192      1.00000
     20     -18.3821      1.00000
     21     -18.2547      1.00000
     22     -18.1836      1.00000
     23     -18.1261      1.00000
     24     -18.0454      1.00000
     25     -17.9698      1.00000
     26     -17.9077      1.00000
     27     -14.2229      1.00000
     28     -14.2215      1.00000
     29     -14.0743      1.00000
     30     -14.0636      1.00000
     31     -12.7969      1.00000
     32     -12.7628      1.00000
     33      -9.2248      1.00000
     34      -9.2125      1.00000
     35      -6.2597      1.00000
     36      -6.2508      1.00000
     37      -5.8390      1.00000
     38      -5.7673      1.00000
     39      -5.3542      1.00000
     40      -5.2841      1.00000
     41      -3.9896      1.00000
     42      -3.9090      1.00000
     43      -3.7383      1.00000
     44      -3.6816      1.00000
     45      -3.1340      1.00000
     46      -3.1247      1.00000
     47      -2.7776      1.00000
     48      -2.7733      1.00000
     49      -2.5752      1.00000
     50      -2.5675      1.00000
     51      -1.4305      0.00000
     52      -1.4093      0.00000
     53       0.1341      0.00000
     54       0.1804      0.00000
     55       0.6261      0.00000
     56       0.6377      0.00000
     57       1.0528      0.00000
     58       1.0764      0.00000
     59       1.4954      0.00000
     60       1.5530      0.00000
     61       1.8483      0.00000
     62       1.8931      0.00000
     63       2.6339      0.00000
     64       2.6661      0.00000
     65       2.8622      0.00000
     66       2.9064      0.00000
     67       2.9415      0.00000
     68       3.0060      0.00000
     69       3.6229      0.00000
     70       3.6959      0.00000
     71       4.2359      0.00000
     72       4.2878      0.00000

 k-point    87 :       0.3776    0.2449    0.0000
  band No.  band energies     occupation 
      1     -36.3672      1.00000
      2     -36.3659      1.00000
      3     -36.2569      1.00000
      4     -36.2567      1.00000
      5     -23.9354      1.00000
      6     -23.9337      1.00000
      7     -23.9306      1.00000
      8     -23.9267      1.00000
      9     -22.9149      1.00000
     10     -22.9125      1.00000
     11     -22.9034      1.00000
     12     -22.8993      1.00000
     13     -22.8776      1.00000
     14     -22.8770      1.00000
     15     -19.4051      1.00000
     16     -19.3272      1.00000
     17     -19.2343      1.00000
     18     -19.2168      1.00000
     19     -18.4206      1.00000
     20     -18.3843      1.00000
     21     -18.2530      1.00000
     22     -18.1845      1.00000
     23     -18.1274      1.00000
     24     -18.0439      1.00000
     25     -17.9732      1.00000
     26     -17.9084      1.00000
     27     -14.2158      1.00000
     28     -14.2143      1.00000
     29     -14.0747      1.00000
     30     -14.0638      1.00000
     31     -12.7963      1.00000
     32     -12.7618      1.00000
     33      -9.2263      1.00000
     34      -9.2138      1.00000
     35      -6.2453      1.00000
     36      -6.2364      1.00000
     37      -5.8544      1.00000
     38      -5.7866      1.00000
     39      -5.3797      1.00000
     40      -5.3149      1.00000
     41      -3.9919      1.00000
     42      -3.9147      1.00000
     43      -3.7367      1.00000
     44      -3.6836      1.00000
     45      -3.1218      1.00000
     46      -3.1119      1.00000
     47      -2.7887      1.00000
     48      -2.7851      1.00000
     49      -2.5770      1.00000
     50      -2.5696      1.00000
     51      -1.4199      0.00000
     52      -1.3999      0.00000
     53       0.1406      0.00000
     54       0.1879      0.00000
     55       0.6467      0.00000
     56       0.6588      0.00000
     57       1.0549      0.00000
     58       1.0794      0.00000
     59       1.4840      0.00000
     60       1.5457      0.00000
     61       1.8533      0.00000
     62       1.9001      0.00000
     63       2.6412      0.00000
     64       2.6741      0.00000
     65       2.8687      0.00000
     66       2.8788      0.00000
     67       2.9299      0.00000
     68       3.0296      0.00000
     69       3.6179      0.00000
     70       3.6948      0.00000
     71       4.2950      0.00000
     72       4.3431      0.00000

 k-point    88 :       0.3741    0.2517    0.0000
  band No.  band energies     occupation 
      1     -36.3671      1.00000
      2     -36.3657      1.00000
      3     -36.2568      1.00000
      4     -36.2566      1.00000
      5     -23.9353      1.00000
      6     -23.9337      1.00000
      7     -23.9307      1.00000
      8     -23.9267      1.00000
      9     -22.9146      1.00000
     10     -22.9123      1.00000
     11     -22.9037      1.00000
     12     -22.8994      1.00000
     13     -22.8777      1.00000
     14     -22.8771      1.00000
     15     -19.4055      1.00000
     16     -19.3267      1.00000
     17     -19.2342      1.00000
     18     -19.2168      1.00000
     19     -18.4220      1.00000
     20     -18.3865      1.00000
     21     -18.2513      1.00000
     22     -18.1856      1.00000
     23     -18.1286      1.00000
     24     -18.0424      1.00000
     25     -17.9767      1.00000
     26     -17.9090      1.00000
     27     -14.2088      1.00000
     28     -14.2071      1.00000
     29     -14.0754      1.00000
     30     -14.0642      1.00000
     31     -12.7958      1.00000
     32     -12.7608      1.00000
     33      -9.2279      1.00000
     34      -9.2151      1.00000
     35      -6.2318      1.00000
     36      -6.2230      1.00000
     37      -5.8669      1.00000
     38      -5.8031      1.00000
     39      -5.4056      1.00000
     40      -5.3457      1.00000
     41      -3.9932      1.00000
     42      -3.9190      1.00000
     43      -3.7357      1.00000
     44      -3.6858      1.00000
     45      -3.1094      1.00000
     46      -3.0989      1.00000
     47      -2.7999      1.00000
     48      -2.7968      1.00000
     49      -2.5787      1.00000
     50      -2.5716      1.00000
     51      -1.4105      0.00000
     52      -1.3919      0.00000
     53       0.1469      0.00000
     54       0.1952      0.00000
     55       0.6655      0.00000
     56       0.6782      0.00000
     57       1.0573      0.00000
     58       1.0830      0.00000
     59       1.4742      0.00000
     60       1.5400      0.00000
     61       1.8578      0.00000
     62       1.9067      0.00000
     63       2.6418      0.00000
     64       2.6768      0.00000
     65       2.8430      0.00000
     66       2.8588      0.00000
     67       2.9491      0.00000
     68       3.0588      0.00000
     69       3.6111      0.00000
     70       3.6899      0.00000
     71       4.2888      0.00000
     72       4.3365      0.00000

 k-point    89 :       0.3707    0.2585    0.0000
  band No.  band energies     occupation 
      1     -36.3670      1.00000
      2     -36.3656      1.00000
      3     -36.2568      1.00000
      4     -36.2566      1.00000
      5     -23.9352      1.00000
      6     -23.9336      1.00000
      7     -23.9309      1.00000
      8     -23.9267      1.00000
      9     -22.9144      1.00000
     10     -22.9121      1.00000
     11     -22.9040      1.00000
     12     -22.8995      1.00000
     13     -22.8777      1.00000
     14     -22.8772      1.00000
     15     -19.4058      1.00000
     16     -19.3262      1.00000
     17     -19.2340      1.00000
     18     -19.2168      1.00000
     19     -18.4233      1.00000
     20     -18.3885      1.00000
     21     -18.2496      1.00000
     22     -18.1866      1.00000
     23     -18.1298      1.00000
     24     -18.0407      1.00000
     25     -17.9801      1.00000
     26     -17.9095      1.00000
     27     -14.2018      1.00000
     28     -14.1999      1.00000
     29     -14.0764      1.00000
     30     -14.0648      1.00000
     31     -12.7952      1.00000
     32     -12.7599      1.00000
     33      -9.2295      1.00000
     34      -9.2166      1.00000
     35      -6.2197      1.00000
     36      -6.2109      1.00000
     37      -5.8762      1.00000
     38      -5.8164      1.00000
     39      -5.4318      1.00000
     40      -5.3766      1.00000
     41      -3.9937      1.00000
     42      -3.9221      1.00000
     43      -3.7352      1.00000
     44      -3.6882      1.00000
     45      -3.0970      1.00000
     46      -3.0857      1.00000
     47      -2.8111      1.00000
     48      -2.8084      1.00000
     49      -2.5804      1.00000
     50      -2.5735      1.00000
     51      -1.4024      0.00000
     52      -1.3850      0.00000
     53       0.1528      0.00000
     54       0.2021      0.00000
     55       0.6824      0.00000
     56       0.6959      0.00000
     57       1.0601      0.00000
     58       1.0873      0.00000
     59       1.4660      0.00000
     60       1.5360      0.00000
     61       1.8617      0.00000
     62       1.9129      0.00000
     63       2.6380      0.00000
     64       2.6750      0.00000
     65       2.8136      0.00000
     66       2.8346      0.00000
     67       2.9822      0.00000
     68       3.0910      0.00000
     69       3.6023      0.00000
     70       3.6825      0.00000
     71       4.2944      0.00000
     72       4.4053      0.00000

 k-point    90 :       0.3673    0.2653    0.0000
  band No.  band energies     occupation 
      1     -36.3668      1.00000
      2     -36.3655      1.00000
      3     -36.2567      1.00000
      4     -36.2565      1.00000
      5     -23.9351      1.00000
      6     -23.9336      1.00000
      7     -23.9310      1.00000
      8     -23.9267      1.00000
      9     -22.9142      1.00000
     10     -22.9118      1.00000
     11     -22.9043      1.00000
     12     -22.8995      1.00000
     13     -22.8777      1.00000
     14     -22.8772      1.00000
     15     -19.4061      1.00000
     16     -19.3257      1.00000
     17     -19.2338      1.00000
     18     -19.2168      1.00000
     19     -18.4244      1.00000
     20     -18.3904      1.00000
     21     -18.2479      1.00000
     22     -18.1877      1.00000
     23     -18.1309      1.00000
     24     -18.0389      1.00000
     25     -17.9836      1.00000
     26     -17.9100      1.00000
     27     -14.1950      1.00000
     28     -14.1928      1.00000
     29     -14.0776      1.00000
     30     -14.0656      1.00000
     31     -12.7947      1.00000
     32     -12.7591      1.00000
     33      -9.2312      1.00000
     34      -9.2180      1.00000
     35      -6.2092      1.00000
     36      -6.2003      1.00000
     37      -5.8820      1.00000
     38      -5.8264      1.00000
     39      -5.4582      1.00000
     40      -5.4073      1.00000
     41      -3.9935      1.00000
     42      -3.9240      1.00000
     43      -3.7352      1.00000
     44      -3.6907      1.00000
     45      -3.0847      1.00000
     46      -3.0724      1.00000
     47      -2.8224      1.00000
     48      -2.8198      1.00000
     49      -2.5820      1.00000
     50      -2.5753      1.00000
     51      -1.3953      0.00000
     52      -1.3793      0.00000
     53       0.1585      0.00000
     54       0.2088      0.00000
     55       0.6974      0.00000
     56       0.7116      0.00000
     57       1.0632      0.00000
     58       1.0923      0.00000
     59       1.4591      0.00000
     60       1.5336      0.00000
     61       1.8650      0.00000
     62       1.9186      0.00000
     63       2.6316      0.00000
     64       2.6695      0.00000
     65       2.7857      0.00000
     66       2.8106      0.00000
     67       3.0189      0.00000
     68       3.1246      0.00000
     69       3.5921      0.00000
     70       3.6725      0.00000
     71       4.3089      0.00000
     72       4.3327      0.00000

 k-point    91 :       0.3639    0.2721    0.0000
  band No.  band energies     occupation 
      1     -36.3667      1.00000
      2     -36.3653      1.00000
      3     -36.2567      1.00000
      4     -36.2565      1.00000
      5     -23.9350      1.00000
      6     -23.9336      1.00000
      7     -23.9310      1.00000
      8     -23.9267      1.00000
      9     -22.9140      1.00000
     10     -22.9116      1.00000
     11     -22.9046      1.00000
     12     -22.8996      1.00000
     13     -22.8778      1.00000
     14     -22.8773      1.00000
     15     -19.4063      1.00000
     16     -19.3254      1.00000
     17     -19.2336      1.00000
     18     -19.2169      1.00000
     19     -18.4255      1.00000
     20     -18.3922      1.00000
     21     -18.2463      1.00000
     22     -18.1889      1.00000
     23     -18.1319      1.00000
     24     -18.0369      1.00000
     25     -17.9869      1.00000
     26     -17.9105      1.00000
     27     -14.1884      1.00000
     28     -14.1858      1.00000
     29     -14.0792      1.00000
     30     -14.0667      1.00000
     31     -12.7943      1.00000
     32     -12.7583      1.00000
     33      -9.2328      1.00000
     34      -9.2195      1.00000
     35      -6.2006      1.00000
     36      -6.1913      1.00000
     37      -5.8841      1.00000
     38      -5.8329      1.00000
     39      -5.4845      1.00000
     40      -5.4376      1.00000
     41      -3.9926      1.00000
     42      -3.9249      1.00000
     43      -3.7356      1.00000
     44      -3.6934      1.00000
     45      -3.0725      1.00000
     46      -3.0592      1.00000
     47      -2.8338      1.00000
     48      -2.8307      1.00000
     49      -2.5835      1.00000
     50      -2.5770      1.00000
     51      -1.3892      0.00000
     52      -1.3746      0.00000
     53       0.1638      0.00000
     54       0.2150      0.00000
     55       0.7103      0.00000
     56       0.7252      0.00000
     57       1.0668      0.00000
     58       1.0979      0.00000
     59       1.4536      0.00000
     60       1.5326      0.00000
     61       1.8676      0.00000
     62       1.9238      0.00000
     63       2.6233      0.00000
     64       2.6612      0.00000
     65       2.7602      0.00000
     66       2.7886      0.00000
     67       3.0562      0.00000
     68       3.1584      0.00000
     69       3.5809      0.00000
     70       3.6605      0.00000
     71       4.3423      0.00000
     72       4.3580      0.00000

 k-point    92 :       0.3605    0.2789    0.0000
  band No.  band energies     occupation 
      1     -36.3666      1.00000
      2     -36.3652      1.00000
      3     -36.2566      1.00000
      4     -36.2564      1.00000
      5     -23.9349      1.00000
      6     -23.9336      1.00000
      7     -23.9311      1.00000
      8     -23.9267      1.00000
      9     -22.9138      1.00000
     10     -22.9115      1.00000
     11     -22.9048      1.00000
     12     -22.8997      1.00000
     13     -22.8778      1.00000
     14     -22.8773      1.00000
     15     -19.4066      1.00000
     16     -19.3251      1.00000
     17     -19.2334      1.00000
     18     -19.2170      1.00000
     19     -18.4265      1.00000
     20     -18.3938      1.00000
     21     -18.2447      1.00000
     22     -18.1900      1.00000
     23     -18.1329      1.00000
     24     -18.0349      1.00000
     25     -17.9903      1.00000
     26     -17.9109      1.00000
     27     -14.1821      1.00000
     28     -14.1790      1.00000
     29     -14.0810      1.00000
     30     -14.0679      1.00000
     31     -12.7939      1.00000
     32     -12.7577      1.00000
     33      -9.2344      1.00000
     34      -9.2209      1.00000
     35      -6.1941      1.00000
     36      -6.1840      1.00000
     37      -5.8825      1.00000
     38      -5.8359      1.00000
     39      -5.5105      1.00000
     40      -5.4674      1.00000
     41      -3.9912      1.00000
     42      -3.9249      1.00000
     43      -3.7365      1.00000
     44      -3.6963      1.00000
     45      -3.0606      1.00000
     46      -3.0462      1.00000
     47      -2.8453      1.00000
     48      -2.8412      1.00000
     49      -2.5849      1.00000
     50      -2.5785      1.00000
     51      -1.3841      0.00000
     52      -1.3709      0.00000
     53       0.1687      0.00000
     54       0.2209      0.00000
     55       0.7211      0.00000
     56       0.7368      0.00000
     57       1.0707      0.00000
     58       1.1040      0.00000
     59       1.4493      0.00000
     60       1.5330      0.00000
     61       1.8696      0.00000
     62       1.9285      0.00000
     63       2.6140      0.00000
     64       2.6506      0.00000
     65       2.7377      0.00000
     66       2.7693      0.00000
     67       3.0926      0.00000
     68       3.1916      0.00000
     69       3.5691      0.00000
     70       3.6469      0.00000
     71       4.3487      0.00000
     72       4.3727      0.00000

 k-point    93 :       0.3571    0.2857    0.0000
  band No.  band energies     occupation 
      1     -36.3665      1.00000
      2     -36.3651      1.00000
      3     -36.2566      1.00000
      4     -36.2564      1.00000
      5     -23.9348      1.00000
      6     -23.9336      1.00000
      7     -23.9312      1.00000
      8     -23.9267      1.00000
      9     -22.9136      1.00000
     10     -22.9113      1.00000
     11     -22.9051      1.00000
     12     -22.8998      1.00000
     13     -22.8778      1.00000
     14     -22.8773      1.00000
     15     -19.4068      1.00000
     16     -19.3248      1.00000
     17     -19.2333      1.00000
     18     -19.2170      1.00000
     19     -18.4274      1.00000
     20     -18.3952      1.00000
     21     -18.2432      1.00000
     22     -18.1912      1.00000
     23     -18.1337      1.00000
     24     -18.0327      1.00000
     25     -17.9936      1.00000
     26     -17.9113      1.00000
     27     -14.1760      1.00000
     28     -14.1724      1.00000
     29     -14.0831      1.00000
     30     -14.0694      1.00000
     31     -12.7935      1.00000
     32     -12.7571      1.00000
     33      -9.2359      1.00000
     34      -9.2223      1.00000
     35      -6.1895      1.00000
     36      -6.1782      1.00000
     37      -5.8775      1.00000
     38      -5.8354      1.00000
     39      -5.5362      1.00000
     40      -5.4964      1.00000
     41      -3.9894      1.00000
     42      -3.9241      1.00000
     43      -3.7377      1.00000
     44      -3.6992      1.00000
     45      -3.0491      1.00000
     46      -3.0333      1.00000
     47      -2.8566      1.00000
     48      -2.8512      1.00000
     49      -2.5862      1.00000
     50      -2.5799      1.00000
     51      -1.3798      0.00000
     52      -1.3681      0.00000
     53       0.1732      0.00000
     54       0.2262      0.00000
     55       0.7300      0.00000
     56       0.7464      0.00000
     57       1.0748      0.00000
     58       1.1104      0.00000
     59       1.4461      0.00000
     60       1.5345      0.00000
     61       1.8709      0.00000
     62       1.9325      0.00000
     63       2.6041      0.00000
     64       2.6385      0.00000
     65       2.7183      0.00000
     66       2.7529      0.00000
     67       3.1274      0.00000
     68       3.2234      0.00000
     69       3.5571      0.00000
     70       3.6320      0.00000
     71       4.3719      0.00000
     72       4.4227      0.00000

 k-point    94 :       0.3537    0.2925    0.0000
  band No.  band energies     occupation 
      1     -36.3664      1.00000
      2     -36.3651      1.00000
      3     -36.2565      1.00000
      4     -36.2564      1.00000
      5     -23.9347      1.00000
      6     -23.9336      1.00000
      7     -23.9313      1.00000
      8     -23.9267      1.00000
      9     -22.9134      1.00000
     10     -22.9111      1.00000
     11     -22.9053      1.00000
     12     -22.8998      1.00000
     13     -22.8778      1.00000
     14     -22.8774      1.00000
     15     -19.4070      1.00000
     16     -19.3246      1.00000
     17     -19.2331      1.00000
     18     -19.2171      1.00000
     19     -18.4281      1.00000
     20     -18.3965      1.00000
     21     -18.2418      1.00000
     22     -18.1922      1.00000
     23     -18.1345      1.00000
     24     -18.0304      1.00000
     25     -17.9968      1.00000
     26     -17.9116      1.00000
     27     -14.1704      1.00000
     28     -14.1660      1.00000
     29     -14.0854      1.00000
     30     -14.0710      1.00000
     31     -12.7931      1.00000
     32     -12.7565      1.00000
     33      -9.2373      1.00000
     34      -9.2237      1.00000
     35      -6.1867      1.00000
     36      -6.1740      1.00000
     37      -5.8696      1.00000
     38      -5.8316      1.00000
     39      -5.5611      1.00000
     40      -5.5243      1.00000
     41      -3.9872      1.00000
     42      -3.9227      1.00000
     43      -3.7392      1.00000
     44      -3.7022      1.00000
     45      -3.0382      1.00000
     46      -3.0209      1.00000
     47      -2.8677      1.00000
     48      -2.8606      1.00000
     49      -2.5873      1.00000
     50      -2.5812      1.00000
     51      -1.3763      0.00000
     52      -1.3660      0.00000
     53       0.1772      0.00000
     54       0.2310      0.00000
     55       0.7371      0.00000
     56       0.7541      0.00000
     57       1.0790      0.00000
     58       1.1169      0.00000
     59       1.4439      0.00000
     60       1.5369      0.00000
     61       1.8715      0.00000
     62       1.9359      0.00000
     63       2.5944      0.00000
     64       2.6259      0.00000
     65       2.7022      0.00000
     66       2.7393      0.00000
     67       3.1599      0.00000
     68       3.2531      0.00000
     69       3.5455      0.00000
     70       3.6162      0.00000
     71       4.3961      0.00000
     72       4.4229      0.00000

 k-point    95 :       0.3503    0.2993    0.0000
  band No.  band energies     occupation 
      1     -36.3664      1.00000
      2     -36.3650      1.00000
      3     -36.2565      1.00000
      4     -36.2563      1.00000
      5     -23.9346      1.00000
      6     -23.9336      1.00000
      7     -23.9313      1.00000
      8     -23.9267      1.00000
      9     -22.9133      1.00000
     10     -22.9109      1.00000
     11     -22.9055      1.00000
     12     -22.8999      1.00000
     13     -22.8778      1.00000
     14     -22.8774      1.00000
     15     -19.4071      1.00000
     16     -19.3244      1.00000
     17     -19.2330      1.00000
     18     -19.2172      1.00000
     19     -18.4288      1.00000
     20     -18.3975      1.00000
     21     -18.2406      1.00000
     22     -18.1932      1.00000
     23     -18.1351      1.00000
     24     -18.0280      1.00000
     25     -18.0000      1.00000
     26     -17.9118      1.00000
     27     -14.1651      1.00000
     28     -14.1600      1.00000
     29     -14.0879      1.00000
     30     -14.0727      1.00000
     31     -12.7928      1.00000
     32     -12.7561      1.00000
     33      -9.2386      1.00000
     34      -9.2249      1.00000
     35      -6.1853      1.00000
     36      -6.1712      1.00000
     37      -5.8592      1.00000
     38      -5.8250      1.00000
     39      -5.5850      1.00000
     40      -5.5508      1.00000
     41      -3.9849      1.00000
     42      -3.9210      1.00000
     43      -3.7409      1.00000
     44      -3.7050      1.00000
     45      -3.0283      1.00000
     46      -3.0090      1.00000
     47      -2.8785      1.00000
     48      -2.8692      1.00000
     49      -2.5884      1.00000
     50      -2.5823      1.00000
     51      -1.3734      0.00000
     52      -1.3645      0.00000
     53       0.1807      0.00000
     54       0.2353      0.00000
     55       0.7425      0.00000
     56       0.7601      0.00000
     57       1.0830      0.00000
     58       1.1232      0.00000
     59       1.4425      0.00000
     60       1.5398      0.00000
     61       1.8715      0.00000
     62       1.9385      0.00000
     63       2.5852      0.00000
     64       2.6136      0.00000
     65       2.6891      0.00000
     66       2.7283      0.00000
     67       3.1895      0.00000
     68       3.2798      0.00000
     69       3.5350      0.00000
     70       3.6000      0.00000
     71       4.4194      0.00000
     72       4.4414      0.00000

 k-point    96 :       0.3469    0.3061    0.0000
  band No.  band energies     occupation 
      1     -36.3663      1.00000
      2     -36.3649      1.00000
      3     -36.2565      1.00000
      4     -36.2563      1.00000
      5     -23.9345      1.00000
      6     -23.9336      1.00000
      7     -23.9314      1.00000
      8     -23.9267      1.00000
      9     -22.9132      1.00000
     10     -22.9108      1.00000
     11     -22.9057      1.00000
     12     -22.8999      1.00000
     13     -22.8778      1.00000
     14     -22.8774      1.00000
     15     -19.4073      1.00000
     16     -19.3243      1.00000
     17     -19.2329      1.00000
     18     -19.2173      1.00000
     19     -18.4293      1.00000
     20     -18.3984      1.00000
     21     -18.2395      1.00000
     22     -18.1941      1.00000
     23     -18.1357      1.00000
     24     -18.0256      1.00000
     25     -18.0031      1.00000
     26     -17.9121      1.00000
     27     -14.1605      1.00000
     28     -14.1544      1.00000
     29     -14.0906      1.00000
     30     -14.0744      1.00000
     31     -12.7926      1.00000
     32     -12.7557      1.00000
     33      -9.2398      1.00000
     34      -9.2260      1.00000
     35      -6.1848      1.00000
     36      -6.1695      1.00000
     37      -5.8474      1.00000
     38      -5.8163      1.00000
     39      -5.6074      1.00000
     40      -5.5753      1.00000
     41      -3.9827      1.00000
     42      -3.9190      1.00000
     43      -3.7426      1.00000
     44      -3.7077      1.00000
     45      -3.0194      1.00000
     46      -2.9978      1.00000
     47      -2.8886      1.00000
     48      -2.8768      1.00000
     49      -2.5892      1.00000
     50      -2.5832      1.00000
     51      -1.3712      0.00000
     52      -1.3636      0.00000
     53       0.1837      0.00000
     54       0.2389      0.00000
     55       0.7464      0.00000
     56       0.7645      0.00000
     57       1.0867      0.00000
     58       1.1289      0.00000
     59       1.4417      0.00000
     60       1.5431      0.00000
     61       1.8709      0.00000
     62       1.9404      0.00000
     63       2.5773      0.00000
     64       2.6025      0.00000
     65       2.6786      0.00000
     66       2.7196      0.00000
     67       3.2155      0.00000
     68       3.3030      0.00000
     69       3.5263      0.00000
     70       3.5840      0.00000
     71       4.4367      0.00000
     72       4.4986      0.00000

 k-point    97 :       0.3435    0.3129    0.0000
  band No.  band energies     occupation 
      1     -36.3662      1.00000
      2     -36.3649      1.00000
      3     -36.2565      1.00000
      4     -36.2563      1.00000
      5     -23.9344      1.00000
      6     -23.9337      1.00000
      7     -23.9314      1.00000
      8     -23.9267      1.00000
      9     -22.9131      1.00000
     10     -22.9107      1.00000
     11     -22.9059      1.00000
     12     -22.8999      1.00000
     13     -22.8778      1.00000
     14     -22.8774      1.00000
     15     -19.4074      1.00000
     16     -19.3242      1.00000
     17     -19.2328      1.00000
     18     -19.2174      1.00000
     19     -18.4297      1.00000
     20     -18.3991      1.00000
     21     -18.2386      1.00000
     22     -18.1948      1.00000
     23     -18.1361      1.00000
     24     -18.0230      1.00000
     25     -18.0062      1.00000
     26     -17.9122      1.00000
     27     -14.1566      1.00000
     28     -14.1495      1.00000
     29     -14.0931      1.00000
     30     -14.0759      1.00000
     31     -12.7924      1.00000
     32     -12.7554      1.00000
     33      -9.2407      1.00000
     34      -9.2269      1.00000
     35      -6.1849      1.00000
     36      -6.1686      1.00000
     37      -5.8352      1.00000
     38      -5.8064      1.00000
     39      -5.6276      1.00000
     40      -5.5969      1.00000
     41      -3.9806      1.00000
     42      -3.9171      1.00000
     43      -3.7443      1.00000
     44      -3.7100      1.00000
     45      -3.0121      1.00000
     46      -2.9878      1.00000
     47      -2.8978      1.00000
     48      -2.8831      1.00000
     49      -2.5899      1.00000
     50      -2.5839      1.00000
     51      -1.3695      0.00000
     52      -1.3632      0.00000
     53       0.1860      0.00000
     54       0.2419      0.00000
     55       0.7491      0.00000
     56       0.7677      0.00000
     57       1.0899      0.00000
     58       1.1338      0.00000
     59       1.4413      0.00000
     60       1.5463      0.00000
     61       1.8699      0.00000
     62       1.9416      0.00000
     63       2.5710      0.00000
     64       2.5935      0.00000
     65       2.6706      0.00000
     66       2.7130      0.00000
     67       3.2370      0.00000
     68       3.3216      0.00000
     69       3.5204      0.00000
     70       3.5687      0.00000
     71       4.4730      0.00000
     72       4.5149      0.00000

 k-point    98 :       0.3401    0.3197    0.0000
  band No.  band energies     occupation 
      1     -36.3662      1.00000
      2     -36.3648      1.00000
      3     -36.2565      1.00000
      4     -36.2563      1.00000
      5     -23.9343      1.00000
      6     -23.9337      1.00000
      7     -23.9314      1.00000
      8     -23.9267      1.00000
      9     -22.9131      1.00000
     10     -22.9106      1.00000
     11     -22.9060      1.00000
     12     -22.9000      1.00000
     13     -22.8778      1.00000
     14     -22.8775      1.00000
     15     -19.4074      1.00000
     16     -19.3242      1.00000
     17     -19.2327      1.00000
     18     -19.2174      1.00000
     19     -18.4301      1.00000
     20     -18.3996      1.00000
     21     -18.2379      1.00000
     22     -18.1954      1.00000
     23     -18.1364      1.00000
     24     -18.0204      1.00000
     25     -18.0092      1.00000
     26     -17.9123      1.00000
     27     -14.1536      1.00000
     28     -14.1455      1.00000
     29     -14.0954      1.00000
     30     -14.0772      1.00000
     31     -12.7923      1.00000
     32     -12.7552      1.00000
     33      -9.2415      1.00000
     34      -9.2275      1.00000
     35      -6.1853      1.00000
     36      -6.1682      1.00000
     37      -5.8242      1.00000
     38      -5.7966      1.00000
     39      -5.6446      1.00000
     40      -5.6143      1.00000
     41      -3.9789      1.00000
     42      -3.9153      1.00000
     43      -3.7458      1.00000
     44      -3.7119      1.00000
     45      -3.0065      1.00000
     46      -2.9794      1.00000
     47      -2.9055      1.00000
     48      -2.8879      1.00000
     49      -2.5904      1.00000
     50      -2.5845      1.00000
     51      -1.3683      0.00000
     52      -1.3631      0.00000
     53       0.1877      0.00000
     54       0.2441      0.00000
     55       0.7508      0.00000
     56       0.7697      0.00000
     57       1.0923      0.00000
     58       1.1375      0.00000
     59       1.4413      0.00000
     60       1.5490      0.00000
     61       1.8688      0.00000
     62       1.9423      0.00000
     63       2.5667      0.00000
     64       2.5868      0.00000
     65       2.6648      0.00000
     66       2.7082      0.00000
     67       3.2533      0.00000
     68       3.3350      0.00000
     69       3.5177      0.00000
     70       3.5553      0.00000
     71       4.4812      0.00000
     72       4.5162      0.00000

 k-point    99 :       0.3367    0.3265    0.0000
  band No.  band energies     occupation 
      1     -36.3662      1.00000
      2     -36.3648      1.00000
      3     -36.2564      1.00000
      4     -36.2563      1.00000
      5     -23.9343      1.00000
      6     -23.9337      1.00000
      7     -23.9314      1.00000
      8     -23.9267      1.00000
      9     -22.9130      1.00000
     10     -22.9106      1.00000
     11     -22.9060      1.00000
     12     -22.9000      1.00000
     13     -22.8778      1.00000
     14     -22.8775      1.00000
     15     -19.4075      1.00000
     16     -19.3241      1.00000
     17     -19.2327      1.00000
     18     -19.2175      1.00000
     19     -18.4302      1.00000
     20     -18.4000      1.00000
     21     -18.2375      1.00000
     22     -18.1957      1.00000
     23     -18.1366      1.00000
     24     -18.0177      1.00000
     25     -18.0121      1.00000
     26     -17.9124      1.00000
     27     -14.1516      1.00000
     28     -14.1427      1.00000
     29     -14.0971      1.00000
     30     -14.0781      1.00000
     31     -12.7922      1.00000
     32     -12.7551      1.00000
     33      -9.2419      1.00000
     34      -9.2280      1.00000
     35      -6.1857      1.00000
     36      -6.1682      1.00000
     37      -5.8164      1.00000
     38      -5.7888      1.00000
     39      -5.6565      1.00000
     40      -5.6259      1.00000
     41      -3.9778      1.00000
     42      -3.9141      1.00000
     43      -3.7468      1.00000
     44      -3.7131      1.00000
     45      -3.0031      1.00000
     46      -2.9737      1.00000
     47      -2.9108      1.00000
     48      -2.8908      1.00000
     49      -2.5908      1.00000
     50      -2.5848      1.00000
     51      -1.3675      0.00000
     52      -1.3632      0.00000
     53       0.1887      0.00000
     54       0.2456      0.00000
     55       0.7517      0.00000
     56       0.7708      0.00000
     57       1.0939      0.00000
     58       1.1400      0.00000
     59       1.4414      0.00000
     60       1.5509      0.00000
     61       1.8678      0.00000
     62       1.9425      0.00000
     63       2.5644      0.00000
     64       2.5827      0.00000
     65       2.6612      0.00000
     66       2.7054      0.00000
     67       3.2633      0.00000
     68       3.3430      0.00000
     69       3.5176      0.00000
     70       3.5457      0.00000
     71       4.4855      0.00000
     72       4.5779      0.00000

 k-point   100 :       0.3333    0.3333    0.0000
  band No.  band energies     occupation 
      1     -36.3662      1.00000
      2     -36.3648      1.00000
      3     -36.2564      1.00000
      4     -36.2563      1.00000
      5     -23.9343      1.00000
      6     -23.9338      1.00000
      7     -23.9314      1.00000
      8     -23.9267      1.00000
      9     -22.9130      1.00000
     10     -22.9105      1.00000
     11     -22.9061      1.00000
     12     -22.9000      1.00000
     13     -22.8778      1.00000
     14     -22.8775      1.00000
     15     -19.4075      1.00000
     16     -19.3241      1.00000
     17     -19.2327      1.00000
     18     -19.2175      1.00000
     19     -18.4303      1.00000
     20     -18.4001      1.00000
     21     -18.2374      1.00000
     22     -18.1958      1.00000
     23     -18.1367      1.00000
     24     -18.0151      1.00000
     25     -18.0147      1.00000
     26     -17.9124      1.00000
     27     -14.1510      1.00000
     28     -14.1418      1.00000
     29     -14.0977      1.00000
     30     -14.0784      1.00000
     31     -12.7921      1.00000
     32     -12.7550      1.00000
     33      -9.2421      1.00000
     34      -9.2281      1.00000
     35      -6.1859      1.00000
     36      -6.1682      1.00000
     37      -5.8135      1.00000
     38      -5.7857      1.00000
     39      -5.6610      1.00000
     40      -5.6299      1.00000
     41      -3.9774      1.00000
     42      -3.9137      1.00000
     43      -3.7472      1.00000
     44      -3.7135      1.00000
     45      -3.0019      1.00000
     46      -2.9717      1.00000
     47      -2.9127      1.00000
     48      -2.8917      1.00000
     49      -2.5909      1.00000
     50      -2.5848      1.00000
     51      -1.3672      0.00000
     52      -1.3633      0.00000
     53       0.1890      0.00000
     54       0.2462      0.00000
     55       0.7519      0.00000
     56       0.7711      0.00000
     57       1.0944      0.00000
     58       1.1408      0.00000
     59       1.4415      0.00000
     60       1.5516      0.00000
     61       1.8673      0.00000
     62       1.9426      0.00000
     63       2.5641      0.00000
     64       2.5810      0.00000
     65       2.6599      0.00000
     66       2.7044      0.00000
     67       3.2667      0.00000
     68       3.3456      0.00000
     69       3.5175      0.00000
     70       3.5427      0.00000
     71       4.5036      0.00000
     72       4.5448      0.00000

 k-point   101 :       0.3333    0.3333    0.0000
  band No.  band energies     occupation 
      1     -36.3662      1.00000
      2     -36.3648      1.00000
      3     -36.2564      1.00000
      4     -36.2563      1.00000
      5     -23.9343      1.00000
      6     -23.9338      1.00000
      7     -23.9314      1.00000
      8     -23.9267      1.00000
      9     -22.9130      1.00000
     10     -22.9105      1.00000
     11     -22.9061      1.00000
     12     -22.9000      1.00000
     13     -22.8778      1.00000
     14     -22.8775      1.00000
     15     -19.4075      1.00000
     16     -19.3241      1.00000
     17     -19.2327      1.00000
     18     -19.2175      1.00000
     19     -18.4303      1.00000
     20     -18.4001      1.00000
     21     -18.2374      1.00000
     22     -18.1958      1.00000
     23     -18.1367      1.00000
     24     -18.0151      1.00000
     25     -18.0147      1.00000
     26     -17.9124      1.00000
     27     -14.1510      1.00000
     28     -14.1418      1.00000
     29     -14.0977      1.00000
     30     -14.0784      1.00000
     31     -12.7921      1.00000
     32     -12.7550      1.00000
     33      -9.2421      1.00000
     34      -9.2281      1.00000
     35      -6.1859      1.00000
     36      -6.1682      1.00000
     37      -5.8135      1.00000
     38      -5.7857      1.00000
     39      -5.6610      1.00000
     40      -5.6299      1.00000
     41      -3.9774      1.00000
     42      -3.9137      1.00000
     43      -3.7472      1.00000
     44      -3.7135      1.00000
     45      -3.0019      1.00000
     46      -2.9717      1.00000
     47      -2.9127      1.00000
     48      -2.8917      1.00000
     49      -2.5909      1.00000
     50      -2.5848      1.00000
     51      -1.3672      0.00000
     52      -1.3633      0.00000
     53       0.1890      0.00000
     54       0.2462      0.00000
     55       0.7519      0.00000
     56       0.7711      0.00000
     57       1.0944      0.00000
     58       1.1408      0.00000
     59       1.4415      0.00000
     60       1.5516      0.00000
     61       1.8673      0.00000
     62       1.9426      0.00000
     63       2.5641      0.00000
     64       2.5810      0.00000
     65       2.6599      0.00000
     66       2.7044      0.00000
     67       3.2667      0.00000
     68       3.3456      0.00000
     69       3.5175      0.00000
     70       3.5427      0.00000
     71       4.4981      0.00000
     72       4.5035      0.00000

 k-point   102 :       0.3265    0.3265    0.0000
  band No.  band energies     occupation 
      1     -36.3662      1.00000
      2     -36.3648      1.00000
      3     -36.2565      1.00000
      4     -36.2563      1.00000
      5     -23.9343      1.00000
      6     -23.9337      1.00000
      7     -23.9314      1.00000
      8     -23.9267      1.00000
      9     -22.9131      1.00000
     10     -22.9106      1.00000
     11     -22.9060      1.00000
     12     -22.9000      1.00000
     13     -22.8778      1.00000
     14     -22.8775      1.00000
     15     -19.4074      1.00000
     16     -19.3242      1.00000
     17     -19.2327      1.00000
     18     -19.2174      1.00000
     19     -18.4301      1.00000
     20     -18.3996      1.00000
     21     -18.2380      1.00000
     22     -18.1953      1.00000
     23     -18.1364      1.00000
     24     -18.0203      1.00000
     25     -18.0092      1.00000
     26     -17.9123      1.00000
     27     -14.1538      1.00000
     28     -14.1458      1.00000
     29     -14.0952      1.00000
     30     -14.0771      1.00000
     31     -12.7922      1.00000
     32     -12.7552      1.00000
     33      -9.2414      1.00000
     34      -9.2274      1.00000
     35      -6.1850      1.00000
     36      -6.1679      1.00000
     37      -5.8240      1.00000
     38      -5.7980      1.00000
     39      -5.6436      1.00000
     40      -5.6147      1.00000
     41      -3.9793      1.00000
     42      -3.9159      1.00000
     43      -3.7453      1.00000
     44      -3.7116      1.00000
     45      -3.0059      1.00000
     46      -2.9786      1.00000
     47      -2.9065      1.00000
     48      -2.8884      1.00000
     49      -2.5906      1.00000
     50      -2.5843      1.00000
     51      -1.3680      0.00000
     52      -1.3630      0.00000
     53       0.1870      0.00000
     54       0.2445      0.00000
     55       0.7510      0.00000
     56       0.7701      0.00000
     57       1.0920      0.00000
     58       1.1373      0.00000
     59       1.4413      0.00000
     60       1.5483      0.00000
     61       1.8695      0.00000
     62       1.9432      0.00000
     63       2.5675      0.00000
     64       2.5837      0.00000
     65       2.6652      0.00000
     66       2.7091      0.00000
     67       3.2555      0.00000
     68       3.3355      0.00000
     69       3.5157      0.00000
     70       3.5545      0.00000
     71       4.4804      0.00000
     72       4.5427      0.00000

 k-point   103 :       0.3197    0.3197    0.0000
  band No.  band energies     occupation 
      1     -36.3663      1.00000
      2     -36.3649      1.00000
      3     -36.2565      1.00000
      4     -36.2563      1.00000
      5     -23.9345      1.00000
      6     -23.9336      1.00000
      7     -23.9314      1.00000
      8     -23.9267      1.00000
      9     -22.9132      1.00000
     10     -22.9108      1.00000
     11     -22.9057      1.00000
     12     -22.8999      1.00000
     13     -22.8778      1.00000
     14     -22.8774      1.00000
     15     -19.4072      1.00000
     16     -19.3242      1.00000
     17     -19.2329      1.00000
     18     -19.2172      1.00000
     19     -18.4293      1.00000
     20     -18.3984      1.00000
     21     -18.2396      1.00000
     22     -18.1940      1.00000
     23     -18.1356      1.00000
     24     -18.0254      1.00000
     25     -18.0033      1.00000
     26     -17.9121      1.00000
     27     -14.1621      1.00000
     28     -14.1564      1.00000
     29     -14.0891      1.00000
     30     -14.0733      1.00000
     31     -12.7926      1.00000
     32     -12.7558      1.00000
     33      -9.2390      1.00000
     34      -9.2252      1.00000
     35      -6.1823      1.00000
     36      -6.1665      1.00000
     37      -5.8476      1.00000
     38      -5.8236      1.00000
     39      -5.6025      1.00000
     40      -5.5770      1.00000
     41      -3.9854      1.00000
     42      -3.9233      1.00000
     43      -3.7391      1.00000
     44      -3.7054      1.00000
     45      -3.0156      1.00000
     46      -2.9930      1.00000
     47      -2.8942      1.00000
     48      -2.8810      1.00000
     49      -2.5894      1.00000
     50      -2.5829      1.00000
     51      -1.3696      0.00000
     52      -1.3622      0.00000
     53       0.1813      0.00000
     54       0.2389      0.00000
     55       0.7488      0.00000
     56       0.7675      0.00000
     57       1.0849      0.00000
     58       1.1263      0.00000
     59       1.4400      0.00000
     60       1.5382      0.00000
     61       1.8777      0.00000
     62       1.9462      0.00000
     63       2.5729      0.00000
     64       2.5903      0.00000
     65       2.6832      0.00000
     66       2.7243      0.00000
     67       3.2283      0.00000
     68       3.3085      0.00000
     69       3.5193      0.00000
     70       3.5718      0.00000
     71       4.4574      0.00000
     72       4.4837      0.00000

 k-point   104 :       0.3129    0.3129    0.0000
  band No.  band energies     occupation 
      1     -36.3665      1.00000
      2     -36.3651      1.00000
      3     -36.2566      1.00000
      4     -36.2564      1.00000
      5     -23.9347      1.00000
      6     -23.9335      1.00000
      7     -23.9313      1.00000
      8     -23.9267      1.00000
      9     -22.9134      1.00000
     10     -22.9110      1.00000
     11     -22.9054      1.00000
     12     -22.8998      1.00000
     13     -22.8778      1.00000
     14     -22.8774      1.00000
     15     -19.4069      1.00000
     16     -19.3242      1.00000
     17     -19.2331      1.00000
     18     -19.2167      1.00000
     19     -18.4281      1.00000
     20     -18.3963      1.00000
     21     -18.2420      1.00000
     22     -18.1920      1.00000
     23     -18.1341      1.00000
     24     -18.0300      1.00000
     25     -17.9973      1.00000
     26     -17.9116      1.00000
     27     -14.1751      1.00000
     28     -14.1713      1.00000
     29     -14.0819      1.00000
     30     -14.0682      1.00000
     31     -12.7932      1.00000
     32     -12.7567      1.00000
     33      -9.2347      1.00000
     34      -9.2210      1.00000
     35      -6.1777      1.00000
     36      -6.1639      1.00000
     37      -5.8737      1.00000
     38      -5.8496      1.00000
     39      -5.5508      1.00000
     40      -5.5275      1.00000
     41      -3.9960      1.00000
     42      -3.9358      1.00000
     43      -3.7284      1.00000
     44      -3.6950      1.00000
     45      -3.0282      1.00000
     46      -3.0093      1.00000
     47      -2.8816      1.00000
     48      -2.8723      1.00000
     49      -2.5874      1.00000
     50      -2.5806      1.00000
     51      -1.3710      0.00000
     52      -1.3610      0.00000
     53       0.1714      0.00000
     54       0.2291      0.00000
     55       0.7455      0.00000
     56       0.7634      0.00000
     57       1.0734      0.00000
     58       1.1083      0.00000
     59       1.4379      0.00000
     60       1.5226      0.00000
     61       1.8924      0.00000
     62       1.9532      0.00000
     63       2.5770      0.00000
     64       2.5967      0.00000
     65       2.7145      0.00000
     66       2.7511      0.00000
     67       3.1927      0.00000
     68       3.2708      0.00000
     69       3.5245      0.00000
     70       3.5843      0.00000
     71       4.4137      0.00000
     72       4.4215      0.00000

 k-point   105 :       0.3061    0.3061    0.0000
  band No.  band energies     occupation 
      1     -36.3667      1.00000
      2     -36.3653      1.00000
      3     -36.2567      1.00000
      4     -36.2565      1.00000
      5     -23.9349      1.00000
      6     -23.9334      1.00000
      7     -23.9312      1.00000
      8     -23.9268      1.00000
      9     -22.9137      1.00000
     10     -22.9113      1.00000
     11     -22.9049      1.00000
     12     -22.8997      1.00000
     13     -22.8779      1.00000
     14     -22.8774      1.00000
     15     -19.4065      1.00000
     16     -19.3242      1.00000
     17     -19.2333      1.00000
     18     -19.2160      1.00000
     19     -18.4265      1.00000
     20     -18.3934      1.00000
     21     -18.2450      1.00000
     22     -18.1896      1.00000
     23     -18.1321      1.00000
     24     -18.0341      1.00000
     25     -17.9912      1.00000
     26     -17.9110      1.00000
     27     -14.1919      1.00000
     28     -14.1894      1.00000
     29     -14.0749      1.00000
     30     -14.0626      1.00000
     31     -12.7942      1.00000
     32     -12.7579      1.00000
     33      -9.2282      1.00000
     34      -9.2147      1.00000
     35      -6.1719      1.00000
     36      -6.1605      1.00000
     37      -5.8970      1.00000
     38      -5.8703      1.00000
     39      -5.4937      1.00000
     40      -5.4715      1.00000
     41      -4.0104      1.00000
     42      -3.9527      1.00000
     43      -3.7140      1.00000
     44      -3.6811      1.00000
     45      -3.0419      1.00000
     46      -3.0255      1.00000
     47      -2.8707      1.00000
     48      -2.8643      1.00000
     49      -2.5846      1.00000
     50      -2.5776      1.00000
     51      -1.3717      0.00000
     52      -1.3590      0.00000
     53       0.1568      0.00000
     54       0.2149      0.00000
     55       0.7406      0.00000
     56       0.7578      0.00000
     57       1.0583      0.00000
     58       1.0849      0.00000
     59       1.4356      0.00000
     60       1.5044      0.00000
     61       1.9129      0.00000
     62       1.9646      0.00000
     63       2.5791      0.00000
     64       2.6011      0.00000
     65       2.7562      0.00000
     66       2.7878      0.00000
     67       3.1532      0.00000
     68       3.2276      0.00000
     69       3.5264      0.00000
     70       3.5891      0.00000
     71       4.3324      0.00000
     72       4.3676      0.00000

 k-point   106 :       0.2993    0.2993    0.0000
  band No.  band energies     occupation 
      1     -36.3670      1.00000
      2     -36.3657      1.00000
      3     -36.2568      1.00000
      4     -36.2566      1.00000
      5     -23.9351      1.00000
      6     -23.9333      1.00000
      7     -23.9311      1.00000
      8     -23.9268      1.00000
      9     -22.9140      1.00000
     10     -22.9115      1.00000
     11     -22.9045      1.00000
     12     -22.8996      1.00000
     13     -22.8779      1.00000
     14     -22.8774      1.00000
     15     -19.4059      1.00000
     16     -19.3240      1.00000
     17     -19.2336      1.00000
     18     -19.2151      1.00000
     19     -18.4245      1.00000
     20     -18.3897      1.00000
     21     -18.2483      1.00000
     22     -18.1871      1.00000
     23     -18.1294      1.00000
     24     -18.0378      1.00000
     25     -17.9850      1.00000
     26     -17.9102      1.00000
     27     -14.2120      1.00000
     28     -14.2099      1.00000
     29     -14.0687      1.00000
     30     -14.0574      1.00000
     31     -12.7954      1.00000
     32     -12.7596      1.00000
     33      -9.2192      1.00000
     34      -9.2060      1.00000
     35      -6.1659      1.00000
     36      -6.1566      1.00000
     37      -5.9142      1.00000
     38      -5.8835      1.00000
     39      -5.4331      1.00000
     40      -5.4112      1.00000
     41      -4.0277      1.00000
     42      -3.9724      1.00000
     43      -3.6971      1.00000
     44      -3.6643      1.00000
     45      -3.0557      1.00000
     46      -3.0412      1.00000
     47      -2.8619      1.00000
     48      -2.8577      1.00000
     49      -2.5813      1.00000
     50      -2.5741      1.00000
     51      -1.3715      0.00000
     52      -1.3562      0.00000
     53       0.1371      0.00000
     54       0.1960      0.00000
     55       0.7334      0.00000
     56       0.7497      0.00000
     57       1.0411      0.00000
     58       1.0585      0.00000
     59       1.4337      0.00000
     60       1.4867      0.00000
     61       1.9375      0.00000
     62       1.9800      0.00000
     63       2.5798      0.00000
     64       2.6035      0.00000
     65       2.8043      0.00000
     66       2.8305      0.00000
     67       3.1125      0.00000
     68       3.1818      0.00000
     69       3.5228      0.00000
     70       3.5856      0.00000
     71       4.2616      0.00000
     72       4.2987      0.00000

 k-point   107 :       0.2925    0.2925    0.0000
  band No.  band energies     occupation 
      1     -36.3674      1.00000
      2     -36.3660      1.00000
      3     -36.2569      1.00000
      4     -36.2568      1.00000
      5     -23.9353      1.00000
      6     -23.9333      1.00000
      7     -23.9310      1.00000
      8     -23.9268      1.00000
      9     -22.9144      1.00000
     10     -22.9118      1.00000
     11     -22.9040      1.00000
     12     -22.8995      1.00000
     13     -22.8779      1.00000
     14     -22.8774      1.00000
     15     -19.4052      1.00000
     16     -19.3236      1.00000
     17     -19.2337      1.00000
     18     -19.2139      1.00000
     19     -18.4221      1.00000
     20     -18.3851      1.00000
     21     -18.2518      1.00000
     22     -18.1845      1.00000
     23     -18.1261      1.00000
     24     -18.0409      1.00000
     25     -17.9787      1.00000
     26     -17.9093      1.00000
     27     -14.2352      1.00000
     28     -14.2328      1.00000
     29     -14.0635      1.00000
     30     -14.0529      1.00000
     31     -12.7969      1.00000
     32     -12.7616      1.00000
     33      -9.2077      1.00000
     34      -9.1947      1.00000
     35      -6.1607      1.00000
     36      -6.1523      1.00000
     37      -5.9235      1.00000
     38      -5.8880      1.00000
     39      -5.3702      1.00000
     40      -5.3479      1.00000
     41      -4.0469      1.00000
     42      -3.9939      1.00000
     43      -3.6787      1.00000
     44      -3.6456      1.00000
     45      -3.0693      1.00000
     46      -3.0561      1.00000
     47      -2.8555      1.00000
     48      -2.8527      1.00000
     49      -2.5776      1.00000
     50      -2.5704      1.00000
     51      -1.3699      0.00000
     52      -1.3522      0.00000
     53       0.1122      0.00000
     54       0.1724      0.00000
     55       0.7226      0.00000
     56       0.7383      0.00000
     57       1.0217      0.00000
     58       1.0341      0.00000
     59       1.4331      0.00000
     60       1.4726      0.00000
     61       1.9643      0.00000
     62       1.9983      0.00000
     63       2.5796      0.00000
     64       2.6045      0.00000
     65       2.8538      0.00000
     66       2.8741      0.00000
     67       3.0737      0.00000
     68       3.1358      0.00000
     69       3.5138      0.00000
     70       3.5747      0.00000
     71       4.1813      0.00000
     72       4.2186      0.00000

 k-point   108 :       0.2857    0.2857    0.0000
  band No.  band energies     occupation 
      1     -36.3679      1.00000
      2     -36.3665      1.00000
      3     -36.2571      1.00000
      4     -36.2570      1.00000
      5     -23.9354      1.00000
      6     -23.9332      1.00000
      7     -23.9309      1.00000
      8     -23.9268      1.00000
      9     -22.9147      1.00000
     10     -22.9120      1.00000
     11     -22.9035      1.00000
     12     -22.8994      1.00000
     13     -22.8779      1.00000
     14     -22.8774      1.00000
     15     -19.4044      1.00000
     16     -19.3231      1.00000
     17     -19.2336      1.00000
     18     -19.2124      1.00000
     19     -18.4194      1.00000
     20     -18.3798      1.00000
     21     -18.2554      1.00000
     22     -18.1821      1.00000
     23     -18.1222      1.00000
     24     -18.0435      1.00000
     25     -17.9724      1.00000
     26     -17.9083      1.00000
     27     -14.2609      1.00000
     28     -14.2580      1.00000
     29     -14.0597      1.00000
     30     -14.0495      1.00000
     31     -12.7987      1.00000
     32     -12.7640      1.00000
     33      -9.1933      1.00000
     34      -9.1807      1.00000
     35      -6.1565      1.00000
     36      -6.1480      1.00000
     37      -5.9240      1.00000
     38      -5.8840      1.00000
     39      -5.3054      1.00000
     40      -5.2824      1.00000
     41      -4.0669      1.00000
     42      -4.0158      1.00000
     43      -3.6597      1.00000
     44      -3.6259      1.00000
     45      -3.0825      1.00000
     46      -3.0702      1.00000
     47      -2.8514      1.00000
     48      -2.8493      1.00000
     49      -2.5739      1.00000
     50      -2.5667      1.00000
     51      -1.3669      0.00000
     52      -1.3469      0.00000
     53       0.0818      0.00000
     54       0.1440      0.00000
     55       0.7073      0.00000
     56       0.7225      0.00000
     57       0.9996      0.00000
     58       1.0172      0.00000
     59       1.4338      0.00000
     60       1.4645      0.00000
     61       1.9916      0.00000
     62       2.0180      0.00000
     63       2.5787      0.00000
     64       2.6044      0.00000
     65       2.8935      0.00000
     66       2.9146      0.00000
     67       3.0424      0.00000
     68       3.0933      0.00000
     69       3.5003      0.00000
     70       3.5578      0.00000
     71       4.0957      0.00000
     72       4.1309      0.00000

 k-point   109 :       0.2789    0.2789    0.0000
  band No.  band energies     occupation 
      1     -36.3684      1.00000
      2     -36.3671      1.00000
      3     -36.2574      1.00000
      4     -36.2572      1.00000
      5     -23.9356      1.00000
      6     -23.9332      1.00000
      7     -23.9308      1.00000
      8     -23.9269      1.00000
      9     -22.9151      1.00000
     10     -22.9122      1.00000
     11     -22.9030      1.00000
     12     -22.8992      1.00000
     13     -22.8780      1.00000
     14     -22.8774      1.00000
     15     -19.4035      1.00000
     16     -19.3223      1.00000
     17     -19.2333      1.00000
     18     -19.2106      1.00000
     19     -18.4165      1.00000
     20     -18.3737      1.00000
     21     -18.2589      1.00000
     22     -18.1797      1.00000
     23     -18.1177      1.00000
     24     -18.0455      1.00000
     25     -17.9662      1.00000
     26     -17.9071      1.00000
     27     -14.2889      1.00000
     28     -14.2855      1.00000
     29     -14.0572      1.00000
     30     -14.0472      1.00000
     31     -12.8008      1.00000
     32     -12.7668      1.00000
     33      -9.1761      1.00000
     34      -9.1639      1.00000
     35      -6.1524      1.00000
     36      -6.1435      1.00000
     37      -5.9157      1.00000
     38      -5.8721      1.00000
     39      -5.2392      1.00000
     40      -5.2152      1.00000
     41      -4.0866      1.00000
     42      -4.0372      1.00000
     43      -3.6409      1.00000
     44      -3.6058      1.00000
     45      -3.0951      1.00000
     46      -3.0833      1.00000
     47      -2.8492      1.00000
     48      -2.8473      1.00000
     49      -2.5703      1.00000
     50      -2.5633      1.00000
     51      -1.3625      0.00000
     52      -1.3404      0.00000
     53       0.0461      0.00000
     54       0.1106      0.00000
     55       0.6873      0.00000
     56       0.7020      0.00000
     57       0.9796      0.00000
     58       1.0069      0.00000
     59       1.4357      0.00000
     60       1.4643      0.00000
     61       2.0173      0.00000
     62       2.0378      0.00000
     63       2.5770      0.00000
     64       2.6037      0.00000
     65       2.9001      0.00000
     66       2.9492      0.00000
     67       3.0248      0.00000
     68       3.0691      0.00000
     69       3.4833      0.00000
     70       3.5364      0.00000
     71       4.0102      0.00000
     72       4.0425      0.00000

 k-point   110 :       0.2721    0.2721    0.0000
  band No.  band energies     occupation 
      1     -36.3691      1.00000
      2     -36.3677      1.00000
      3     -36.2576      1.00000
      4     -36.2575      1.00000
      5     -23.9358      1.00000
      6     -23.9332      1.00000
      7     -23.9307      1.00000
      8     -23.9269      1.00000
      9     -22.9154      1.00000
     10     -22.9123      1.00000
     11     -22.9025      1.00000
     12     -22.8991      1.00000
     13     -22.8781      1.00000
     14     -22.8775      1.00000
     15     -19.4026      1.00000
     16     -19.3214      1.00000
     17     -19.2327      1.00000
     18     -19.2085      1.00000
     19     -18.4134      1.00000
     20     -18.3668      1.00000
     21     -18.2622      1.00000
     22     -18.1775      1.00000
     23     -18.1126      1.00000
     24     -18.0469      1.00000
     25     -17.9599      1.00000
     26     -17.9058      1.00000
     27     -14.3191      1.00000
     28     -14.3151      1.00000
     29     -14.0562      1.00000
     30     -14.0463      1.00000
     31     -12.8033      1.00000
     32     -12.7699      1.00000
     33      -9.1560      1.00000
     34      -9.1442      1.00000
     35      -6.1472      1.00000
     36      -6.1381      1.00000
     37      -5.8999      1.00000
     38      -5.8535      1.00000
     39      -5.1720      1.00000
     40      -5.1466      1.00000
     41      -4.1051      1.00000
     42      -4.0570      1.00000
     43      -3.6230      1.00000
     44      -3.5860      1.00000
     45      -3.1071      1.00000
     46      -3.0957      1.00000
     47      -2.8485      1.00000
     48      -2.8467      1.00000
     49      -2.5671      1.00000
     50      -2.5603      1.00000
     51      -1.3565      0.00000
     52      -1.3325      0.00000
     53       0.0050      0.00000
     54       0.0720      0.00000
     55       0.6632      0.00000
     56       0.6772      0.00000
     57       0.9649      0.00000
     58       1.0015      0.00000
     59       1.4399      0.00000
     60       1.4719      0.00000
     61       2.0391      0.00000
     62       2.0566      0.00000
     63       2.5742      0.00000
     64       2.6024      0.00000
     65       2.8748      0.00000
     66       2.9461      0.00000
     67       3.0306      0.00000
     68       3.0791      0.00000
     69       3.4635      0.00000
     70       3.5113      0.00000
     71       3.9290      0.00000
     72       3.9580      0.00000

 k-point   111 :       0.2653    0.2653    0.0000
  band No.  band energies     occupation 
      1     -36.3698      1.00000
      2     -36.3684      1.00000
      3     -36.2579      1.00000
      4     -36.2577      1.00000
      5     -23.9359      1.00000
      6     -23.9331      1.00000
      7     -23.9306      1.00000
      8     -23.9270      1.00000
      9     -22.9157      1.00000
     10     -22.9124      1.00000
     11     -22.9021      1.00000
     12     -22.8990      1.00000
     13     -22.8782      1.00000
     14     -22.8776      1.00000
     15     -19.4015      1.00000
     16     -19.3202      1.00000
     17     -19.2317      1.00000
     18     -19.2060      1.00000
     19     -18.4101      1.00000
     20     -18.3593      1.00000
     21     -18.2653      1.00000
     22     -18.1755      1.00000
     23     -18.1071      1.00000
     24     -18.0477      1.00000
     25     -17.9538      1.00000
     26     -17.9044      1.00000
     27     -14.3513      1.00000
     28     -14.3467      1.00000
     29     -14.0567      1.00000
     30     -14.0467      1.00000
     31     -12.8061      1.00000
     32     -12.7734      1.00000
     33      -9.1330      1.00000
     34      -9.1216      1.00000
     35      -6.1395      1.00000
     36      -6.1307      1.00000
     37      -5.8779      1.00000
     38      -5.8295      1.00000
     39      -5.1040      1.00000
     40      -5.0770      1.00000
     41      -4.1212      1.00000
     42      -4.0745      1.00000
     43      -3.6064      1.00000
     44      -3.5671      1.00000
     45      -3.1186      1.00000
     46      -3.1073      1.00000
     47      -2.8491      1.00000
     48      -2.8472      1.00000
     49      -2.5645      1.00000
     50      -2.5578      1.00000
     51      -1.3490      0.00000
     52      -1.3234      0.00000
     53      -0.0410      0.00000
     54       0.0282      0.00000
     55       0.6368      0.00000
     56       0.6498      0.00000
     57       0.9561      0.00000
     58       1.0004      0.00000
     59       1.4479      0.00000
     60       1.4858      0.00000
     61       2.0547      0.00000
     62       2.0736      0.00000
     63       2.5697      0.00000
     64       2.6008      0.00000
     65       2.8358      0.00000
     66       2.9078      0.00000
     67       3.0565      0.00000
     68       3.1009      0.00000
     69       3.4405      0.00000
     70       3.4827      0.00000
     71       3.8560      0.00000
     72       3.8820      0.00000

 k-point   112 :       0.2585    0.2585    0.0000
  band No.  band energies     occupation 
      1     -36.3706      1.00000
      2     -36.3692      1.00000
      3     -36.2583      1.00000
      4     -36.2581      1.00000
      5     -23.9361      1.00000
      6     -23.9331      1.00000
      7     -23.9305      1.00000
      8     -23.9270      1.00000
      9     -22.9160      1.00000
     10     -22.9125      1.00000
     11     -22.9016      1.00000
     12     -22.8989      1.00000
     13     -22.8783      1.00000
     14     -22.8777      1.00000
     15     -19.4003      1.00000
     16     -19.3189      1.00000
     17     -19.2302      1.00000
     18     -19.2033      1.00000
     19     -18.4068      1.00000
     20     -18.3510      1.00000
     21     -18.2681      1.00000
     22     -18.1735      1.00000
     23     -18.1012      1.00000
     24     -18.0478      1.00000
     25     -17.9477      1.00000
     26     -17.9029      1.00000
     27     -14.3853      1.00000
     28     -14.3802      1.00000
     29     -14.0587      1.00000
     30     -14.0487      1.00000
     31     -12.8092      1.00000
     32     -12.7772      1.00000
     33      -9.1072      1.00000
     34      -9.0961      1.00000
     35      -6.1283      1.00000
     36      -6.1201      1.00000
     37      -5.8514      1.00000
     38      -5.8015      1.00000
     39      -5.0357      1.00000
     40      -5.0067      1.00000
     41      -4.1343      1.00000
     42      -4.0888      1.00000
     43      -3.5916      1.00000
     44      -3.5494      1.00000
     45      -3.1295      1.00000
     46      -3.1181      1.00000
     47      -2.8507      1.00000
     48      -2.8484      1.00000
     49      -2.5626      1.00000
     50      -2.5561      1.00000
     51      -1.3401      0.00000
     52      -1.3131      0.00000
     53      -0.0917      0.00000
     54      -0.0205      0.00000
     55       0.6097      0.00000
     56       0.6215      0.00000
     57       0.9527      0.00000
     58       1.0029      0.00000
     59       1.4605      0.00000
     60       1.5048      0.00000
     61       2.0628      0.00000
     62       2.0870      0.00000
     63       2.5631      0.00000
     64       2.5987      0.00000
     65       2.7922      0.00000
     66       2.8616      0.00000
     67       3.0784      0.00000
     68       3.1181      0.00000
     69       3.4133      0.00000
     70       3.4503      0.00000
     71       3.7947      0.00000
     72       3.8185      0.00000

 k-point   113 :       0.2517    0.2517    0.0000
  band No.  band energies     occupation 
      1     -36.3715      1.00000
      2     -36.3701      1.00000
      3     -36.2586      1.00000
      4     -36.2584      1.00000
      5     -23.9362      1.00000
      6     -23.9331      1.00000
      7     -23.9304      1.00000
      8     -23.9271      1.00000
      9     -22.9162      1.00000
     10     -22.9126      1.00000
     11     -22.9012      1.00000
     12     -22.8988      1.00000
     13     -22.8785      1.00000
     14     -22.8778      1.00000
     15     -19.3991      1.00000
     16     -19.3174      1.00000
     17     -19.2283      1.00000
     18     -19.2001      1.00000
     19     -18.4036      1.00000
     20     -18.3422      1.00000
     21     -18.2706      1.00000
     22     -18.1716      1.00000
     23     -18.0949      1.00000
     24     -18.0473      1.00000
     25     -17.9417      1.00000
     26     -17.9013      1.00000
     27     -14.4211      1.00000
     28     -14.4155      1.00000
     29     -14.0623      1.00000
     30     -14.0521      1.00000
     31     -12.8126      1.00000
     32     -12.7814      1.00000
     33      -9.0786      1.00000
     34      -9.0680      1.00000
     35      -6.1128      1.00000
     36      -6.1054      1.00000
     37      -5.8216      1.00000
     38      -5.7705      1.00000
     39      -4.9672      1.00000
     40      -4.9360      1.00000
     41      -4.1434      1.00000
     42      -4.0992      1.00000
     43      -3.5790      1.00000
     44      -3.5335      1.00000
     45      -3.1401      1.00000
     46      -3.1283      1.00000
     47      -2.8530      1.00000
     48      -2.8500      1.00000
     49      -2.5616      1.00000
     50      -2.5550      1.00000
     51      -1.3298      0.00000
     52      -1.3018      0.00000
     53      -0.1466      0.00000
     54      -0.0740      0.00000
     55       0.5836      0.00000
     56       0.5941      0.00000
     57       0.9540      0.00000
     58       1.0087      0.00000
     59       1.4775      0.00000
     60       1.5281      0.00000
     61       2.0632      0.00000
     62       2.0947      0.00000
     63       2.5535      0.00000
     64       2.5954      0.00000
     65       2.7473      0.00000
     66       2.8137      0.00000
     67       3.0896      0.00000
     68       3.1246      0.00000
     69       3.3820      0.00000
     70       3.4154      0.00000
     71       3.7464      0.00000
     72       3.7696      0.00000

 k-point   114 :       0.2449    0.2449    0.0000
  band No.  band energies     occupation 
      1     -36.3724      1.00000
      2     -36.3711      1.00000
      3     -36.2590      1.00000
      4     -36.2588      1.00000
      5     -23.9363      1.00000
      6     -23.9331      1.00000
      7     -23.9303      1.00000
      8     -23.9272      1.00000
      9     -22.9164      1.00000
     10     -22.9126      1.00000
     11     -22.9008      1.00000
     12     -22.8987      1.00000
     13     -22.8786      1.00000
     14     -22.8780      1.00000
     15     -19.3978      1.00000
     16     -19.3157      1.00000
     17     -19.2257      1.00000
     18     -19.1966      1.00000
     19     -18.4003      1.00000
     20     -18.3327      1.00000
     21     -18.2727      1.00000
     22     -18.1696      1.00000
     23     -18.0883      1.00000
     24     -18.0462      1.00000
     25     -17.9358      1.00000
     26     -17.8997      1.00000
     27     -14.4584      1.00000
     28     -14.4523      1.00000
     29     -14.0674      1.00000
     30     -14.0570      1.00000
     31     -12.8164      1.00000
     32     -12.7859      1.00000
     33      -9.0475      1.00000
     34      -9.0373      1.00000
     35      -6.0926      1.00000
     36      -6.0858      1.00000
     37      -5.7896      1.00000
     38      -5.7373      1.00000
     39      -4.8989      1.00000
     40      -4.8651      1.00000
     41      -4.1479      1.00000
     42      -4.1050      1.00000
     43      -3.5687      1.00000
     44      -3.5194      1.00000
     45      -3.1504      1.00000
     46      -3.1380      1.00000
     47      -2.8559      1.00000
     48      -2.8515      1.00000
     49      -2.5615      1.00000
     50      -2.5548      1.00000
     51      -1.3184      0.00000
     52      -1.2894      0.00000
     53      -0.2051      0.00000
     54      -0.1316      0.00000
     55       0.5598      0.00000
     56       0.5690      0.00000
     57       0.9594      0.00000
     58       1.0175      0.00000
     59       1.4981      0.00000
     60       1.5549      0.00000
     61       2.0557      0.00000
     62       2.0955      0.00000
     63       2.5407      0.00000
     64       2.5898      0.00000
     65       2.7025      0.00000
     66       2.7651      0.00000
     67       3.0874      0.00000
     68       3.1175      0.00000
     69       3.3495      0.00000
     70       3.3817      0.00000
     71       3.7092      0.00000
     72       3.7332      0.00000

 k-point   115 :       0.2381    0.2381    0.0000
  band No.  band energies     occupation 
      1     -36.3735      1.00000
      2     -36.3721      1.00000
      3     -36.2595      1.00000
      4     -36.2593      1.00000
      5     -23.9364      1.00000
      6     -23.9330      1.00000
      7     -23.9302      1.00000
      8     -23.9273      1.00000
      9     -22.9165      1.00000
     10     -22.9126      1.00000
     11     -22.9005      1.00000
     12     -22.8986      1.00000
     13     -22.8789      1.00000
     14     -22.8782      1.00000
     15     -19.3965      1.00000
     16     -19.3140      1.00000
     17     -19.2224      1.00000
     18     -19.1926      1.00000
     19     -18.3972      1.00000
     20     -18.3228      1.00000
     21     -18.2744      1.00000
     22     -18.1676      1.00000
     23     -18.0815      1.00000
     24     -18.0444      1.00000
     25     -17.9300      1.00000
     26     -17.8980      1.00000
     27     -14.4971      1.00000
     28     -14.4906      1.00000
     29     -14.0741      1.00000
     30     -14.0633      1.00000
     31     -12.8205      1.00000
     32     -12.7908      1.00000
     33      -9.0140      1.00000
     34      -9.0043      1.00000
     35      -6.0674      1.00000
     36      -6.0608      1.00000
     37      -5.7561      1.00000
     38      -5.7027      1.00000
     39      -4.8311      1.00000
     40      -4.7944      1.00000
     41      -4.1472      1.00000
     42      -4.1056      1.00000
     43      -3.5607      1.00000
     44      -3.5074      1.00000
     45      -3.1606      1.00000
     46      -3.1475      1.00000
     47      -2.8590      1.00000
     48      -2.8528      1.00000
     49      -2.5622      1.00000
     50      -2.5553      1.00000
     51      -1.3060      0.00000
     52      -1.2762      0.00000
     53      -0.2666      0.00000
     54      -0.1929      0.00000
     55       0.5391      0.00000
     56       0.5472      0.00000
     57       0.9688      0.00000
     58       1.0294      0.00000
     59       1.5212      0.00000
     60       1.5844      0.00000
     61       2.0403      0.00000
     62       2.0887      0.00000
     63       2.5242      0.00000
     64       2.5797      0.00000
     65       2.6593      0.00000
     66       2.7156      0.00000
     67       3.0706      0.00000
     68       3.0959      0.00000
     69       3.3211      0.00000
     70       3.3550      0.00000
     71       3.6785      0.00000
     72       3.7030      0.00000

 k-point   116 :       0.2313    0.2313    0.0000
  band No.  band energies     occupation 
      1     -36.3746      1.00000
      2     -36.3732      1.00000
      3     -36.2599      1.00000
      4     -36.2597      1.00000
      5     -23.9364      1.00000
      6     -23.9330      1.00000
      7     -23.9302      1.00000
      8     -23.9274      1.00000
      9     -22.9166      1.00000
     10     -22.9125      1.00000
     11     -22.9001      1.00000
     12     -22.8985      1.00000
     13     -22.8791      1.00000
     14     -22.8785      1.00000
     15     -19.3951      1.00000
     16     -19.3124      1.00000
     17     -19.2185      1.00000
     18     -19.1883      1.00000
     19     -18.3942      1.00000
     20     -18.3125      1.00000
     21     -18.2755      1.00000
     22     -18.1653      1.00000
     23     -18.0745      1.00000
     24     -18.0419      1.00000
     25     -17.9244      1.00000
     26     -17.8963      1.00000
     27     -14.5370      1.00000
     28     -14.5301      1.00000
     29     -14.0822      1.00000
     30     -14.0712      1.00000
     31     -12.8250      1.00000
     32     -12.7960      1.00000
     33      -8.9785      1.00000
     34      -8.9692      1.00000
     35      -6.0369      1.00000
     36      -6.0301      1.00000
     37      -5.7216      1.00000
     38      -5.6672      1.00000
     39      -4.7641      1.00000
     40      -4.7242      1.00000
     41      -4.1407      1.00000
     42      -4.1006      1.00000
     43      -3.5550      1.00000
     44      -3.4974      1.00000
     45      -3.1711      1.00000
     46      -3.1572      1.00000
     47      -2.8619      1.00000
     48      -2.8536      1.00000
     49      -2.5637      1.00000
     50      -2.5566      1.00000
     51      -1.2926      0.00000
     52      -1.2623      0.00000
     53      -0.3305      0.00000
     54      -0.2570      0.00000
     55       0.5220      0.00000
     56       0.5293      0.00000
     57       0.9821      0.00000
     58       1.0446      0.00000
     59       1.5457      0.00000
     60       1.6155      0.00000
     61       2.0175      0.00000
     62       2.0741      0.00000
     63       2.5041      0.00000
     64       2.5614      0.00000
     65       2.6202      0.00000
     66       2.6644      0.00000
     67       3.0406      0.00000
     68       3.0620      0.00000
     69       3.3014      0.00000
     70       3.3381      0.00000
     71       3.6494      0.00000
     72       3.6739      0.00000

 k-point   117 :       0.2245    0.2245    0.0000
  band No.  band energies     occupation 
      1     -36.3758      1.00000
      2     -36.3744      1.00000
      3     -36.2604      1.00000
      4     -36.2602      1.00000
      5     -23.9365      1.00000
      6     -23.9330      1.00000
      7     -23.9301      1.00000
      8     -23.9275      1.00000
      9     -22.9166      1.00000
     10     -22.9124      1.00000
     11     -22.8998      1.00000
     12     -22.8985      1.00000
     13     -22.8794      1.00000
     14     -22.8787      1.00000
     15     -19.3936      1.00000
     16     -19.3107      1.00000
     17     -19.2138      1.00000
     18     -19.1836      1.00000
     19     -18.3913      1.00000
     20     -18.3021      1.00000
     21     -18.2759      1.00000
     22     -18.1627      1.00000
     23     -18.0675      1.00000
     24     -18.0388      1.00000
     25     -17.9190      1.00000
     26     -17.8946      1.00000
     27     -14.5779      1.00000
     28     -14.5706      1.00000
     29     -14.0918      1.00000
     30     -14.0804      1.00000
     31     -12.8297      1.00000
     32     -12.8014      1.00000
     33      -8.9412      1.00000
     34      -8.9324      1.00000
     35      -6.0010      1.00000
     36      -5.9935      1.00000
     37      -5.6867      1.00000
     38      -5.6309      1.00000
     39      -4.6981      1.00000
     40      -4.6548      1.00000
     41      -4.1282      1.00000
     42      -4.0896      1.00000
     43      -3.5512      1.00000
     44      -3.4893      1.00000
     45      -3.1821      1.00000
     46      -3.1675      1.00000
     47      -2.8645      1.00000
     48      -2.8536      1.00000
     49      -2.5659      1.00000
     50      -2.5586      1.00000
     51      -1.2784      0.00000
     52      -1.2478      0.00000
     53      -0.3962      0.00000
     54      -0.3233      0.00000
     55       0.5088      0.00000
     56       0.5156      0.00000
     57       0.9992      0.00000
     58       1.0633      0.00000
     59       1.5701      0.00000
     60       1.6472      0.00000
     61       1.9880      0.00000
     62       2.0522      0.00000
     63       2.4801      0.00000
     64       2.5309      0.00000
     65       2.5883      0.00000
     66       2.6109      0.00000
     67       3.0021      0.00000
     68       3.0214      0.00000
     69       3.2904      0.00000
     70       3.3296      0.00000
     71       3.6143      0.00000
     72       3.6382      0.00000

 k-point   118 :       0.2177    0.2177    0.0000
  band No.  band energies     occupation 
      1     -36.3770      1.00000
      2     -36.3757      1.00000
      3     -36.2610      1.00000
      4     -36.2608      1.00000
      5     -23.9365      1.00000
      6     -23.9330      1.00000
      7     -23.9301      1.00000
      8     -23.9276      1.00000
      9     -22.9166      1.00000
     10     -22.9123      1.00000
     11     -22.8995      1.00000
     12     -22.8985      1.00000
     13     -22.8797      1.00000
     14     -22.8791      1.00000
     15     -19.3921      1.00000
     16     -19.3092      1.00000
     17     -19.2084      1.00000
     18     -19.1785      1.00000
     19     -18.3887      1.00000
     20     -18.2924      1.00000
     21     -18.2748      1.00000
     22     -18.1598      1.00000
     23     -18.0605      1.00000
     24     -18.0350      1.00000
     25     -17.9137      1.00000
     26     -17.8928      1.00000
     27     -14.6197      1.00000
     28     -14.6120      1.00000
     29     -14.1027      1.00000
     30     -14.0910      1.00000
     31     -12.8348      1.00000
     32     -12.8072      1.00000
     33      -8.9024      1.00000
     34      -8.8941      1.00000
     35      -5.9596      1.00000
     36      -5.9510      1.00000
     37      -5.6513      1.00000
     38      -5.5941      1.00000
     39      -4.6337      1.00000
     40      -4.5867      1.00000
     41      -4.1095      1.00000
     42      -4.0725      1.00000
     43      -3.5490      1.00000
     44      -3.4826      1.00000
     45      -3.1941      1.00000
     46      -3.1788      1.00000
     47      -2.8664      1.00000
     48      -2.8528      1.00000
     49      -2.5689      1.00000
     50      -2.5612      1.00000
     51      -1.2637      0.00000
     52      -1.2328      0.00000
     53      -0.4631      0.00000
     54      -0.3911      0.00000
     55       0.4996      0.00000
     56       0.5064      0.00000
     57       1.0203      0.00000
     58       1.0857      0.00000
     59       1.5929      0.00000
     60       1.6779      0.00000
     61       1.9530      0.00000
     62       2.0239      0.00000
     63       2.4499      0.00000
     64       2.4919      0.00000
     65       2.5514      0.00000
     66       2.5651      0.00000
     67       2.9601      0.00000
     68       2.9797      0.00000
     69       3.2859      0.00000
     70       3.3257      0.00000
     71       3.5722      0.00000
     72       3.6036      0.00000

 k-point   119 :       0.2109    0.2109    0.0000
  band No.  band energies     occupation 
      1     -36.3784      1.00000
      2     -36.3770      1.00000
      3     -36.2615      1.00000
      4     -36.2613      1.00000
      5     -23.9365      1.00000
      6     -23.9330      1.00000
      7     -23.9301      1.00000
      8     -23.9278      1.00000
      9     -22.9165      1.00000
     10     -22.9121      1.00000
     11     -22.8992      1.00000
     12     -22.8984      1.00000
     13     -22.8800      1.00000
     14     -22.8794      1.00000
     15     -19.3905      1.00000
     16     -19.3078      1.00000
     17     -19.2022      1.00000
     18     -19.1730      1.00000
     19     -18.3862      1.00000
     20     -18.2860      1.00000
     21     -18.2697      1.00000
     22     -18.1565      1.00000
     23     -18.0536      1.00000
     24     -18.0304      1.00000
     25     -17.9086      1.00000
     26     -17.8911      1.00000
     27     -14.6621      1.00000
     28     -14.6540      1.00000
     29     -14.1149      1.00000
     30     -14.1029      1.00000
     31     -12.8401      1.00000
     32     -12.8132      1.00000
     33      -8.8626      1.00000
     34      -8.8548      1.00000
     35      -5.9127      1.00000
     36      -5.9025      1.00000
     37      -5.6156      1.00000
     38      -5.5567      1.00000
     39      -4.5711      1.00000
     40      -4.5201      1.00000
     41      -4.0847      1.00000
     42      -4.0492      1.00000
     43      -3.5478      1.00000
     44      -3.4770      1.00000
     45      -3.2072      1.00000
     46      -3.1915      1.00000
     47      -2.8676      1.00000
     48      -2.8510      1.00000
     49      -2.5724      1.00000
     50      -2.5646      1.00000
     51      -1.2484      0.00000
     52      -1.2174      0.00000
     53      -0.5307      0.00000
     54      -0.4597      0.00000
     55       0.4947      0.00000
     56       0.5019      0.00000
     57       1.0453      0.00000
     58       1.1118      0.00000
     59       1.6124      0.00000
     60       1.7057      0.00000
     61       1.9140      0.00000
     62       1.9904      0.00000
     63       2.4080      0.00000
     64       2.4531      0.00000
     65       2.4952      0.00000
     66       2.5400      0.00000
     67       2.9187      0.00000
     68       2.9406      0.00000
     69       3.2835      0.00000
     70       3.3223      0.00000
     71       3.5228      0.00000
     72       3.5491      0.00000

 k-point   120 :       0.2041    0.2041    0.0000
  band No.  band energies     occupation 
      1     -36.3797      1.00000
      2     -36.3784      1.00000
      3     -36.2621      1.00000
      4     -36.2619      1.00000
      5     -23.9365      1.00000
      6     -23.9330      1.00000
      7     -23.9300      1.00000
      8     -23.9279      1.00000
      9     -22.9164      1.00000
     10     -22.9119      1.00000
     11     -22.8990      1.00000
     12     -22.8984      1.00000
     13     -22.8804      1.00000
     14     -22.8797      1.00000
     15     -19.3889      1.00000
     16     -19.3065      1.00000
     17     -19.1953      1.00000
     18     -19.1671      1.00000
     19     -18.3839      1.00000
     20     -18.2836      1.00000
     21     -18.2599      1.00000
     22     -18.1527      1.00000
     23     -18.0469      1.00000
     24     -18.0251      1.00000
     25     -17.9038      1.00000
     26     -17.8893      1.00000
     27     -14.7049      1.00000
     28     -14.6966      1.00000
     29     -14.1284      1.00000
     30     -14.1160      1.00000
     31     -12.8458      1.00000
     32     -12.8195      1.00000
     33      -8.8220      1.00000
     34      -8.8148      1.00000
     35      -5.8603      1.00000
     36      -5.8482      1.00000
     37      -5.5794      1.00000
     38      -5.5183      1.00000
     39      -4.5108      1.00000
     40      -4.4557      1.00000
     41      -4.0541      1.00000
     42      -4.0200      1.00000
     43      -3.5470      1.00000
     44      -3.4717      1.00000
     45      -3.2218      1.00000
     46      -3.2058      1.00000
     47      -2.8680      1.00000
     48      -2.8483      1.00000
     49      -2.5765      1.00000
     50      -2.5684      1.00000
     51      -1.2327      0.00000
     52      -1.2017      0.00000
     53      -0.5984      0.00000
     54      -0.5287      0.00000
     55       0.4941      0.00000
     56       0.5020      0.00000
     57       1.0743      0.00000
     58       1.1418      0.00000
     59       1.6267      0.00000
     60       1.7271      0.00000
     61       1.8742      0.00000
     62       1.9530      0.00000
     63       2.3533      0.00000
     64       2.4063      0.00000
     65       2.4508      0.00000
     66       2.5162      0.00000
     67       2.8801      0.00000
     68       2.9055      0.00000
     69       3.2805      0.00000
     70       3.3149      0.00000
     71       3.4640      0.00000
     72       3.4960      0.00000

 k-point   121 :       0.1973    0.1973    0.0000
  band No.  band energies     occupation 
      1     -36.3812      1.00000
      2     -36.3798      1.00000
      3     -36.2627      1.00000
      4     -36.2625      1.00000
      5     -23.9365      1.00000
      6     -23.9330      1.00000
      7     -23.9300      1.00000
      8     -23.9280      1.00000
      9     -22.9163      1.00000
     10     -22.9117      1.00000
     11     -22.8988      1.00000
     12     -22.8984      1.00000
     13     -22.8808      1.00000
     14     -22.8801      1.00000
     15     -19.3872      1.00000
     16     -19.3054      1.00000
     17     -19.1878      1.00000
     18     -19.1609      1.00000
     19     -18.3817      1.00000
     20     -18.2827      1.00000
     21     -18.2480      1.00000
     22     -18.1483      1.00000
     23     -18.0404      1.00000
     24     -18.0190      1.00000
     25     -17.8991      1.00000
     26     -17.8875      1.00000
     27     -14.7481      1.00000
     28     -14.7395      1.00000
     29     -14.1429      1.00000
     30     -14.1302      1.00000
     31     -12.8517      1.00000
     32     -12.8261      1.00000
     33      -8.7812      1.00000
     34      -8.7745      1.00000
     35      -5.8027      1.00000
     36      -5.7880      1.00000
     37      -5.5425      1.00000
     38      -5.4785      1.00000
     39      -4.4533      1.00000
     40      -4.3939      1.00000
     41      -4.0182      1.00000
     42      -3.9850      1.00000
     43      -3.5458      1.00000
     44      -3.4660      1.00000
     45      -3.2380      1.00000
     46      -3.2218      1.00000
     47      -2.8675      1.00000
     48      -2.8448      1.00000
     49      -2.5810      1.00000
     50      -2.5728      1.00000
     51      -1.2166      0.00000
     52      -1.1856      0.00000
     53      -0.6659      0.00000
     54      -0.5976      0.00000
     55       0.4979      0.00000
     56       0.5067      0.00000
     57       1.1070      0.00000
     58       1.1753      0.00000
     59       1.6340      0.00000
     60       1.7337      0.00000
     61       1.8412      0.00000
     62       1.9134      0.00000
     63       2.2908      0.00000
     64       2.3428      0.00000
     65       2.4262      0.00000
     66       2.4935      0.00000
     67       2.8451      0.00000
     68       2.8740      0.00000
     69       3.2723      0.00000
     70       3.2952      0.00000
     71       3.4080      0.00000
     72       3.4680      0.00000

 k-point   122 :       0.1905    0.1905    0.0000
  band No.  band energies     occupation 
      1     -36.3826      1.00000
      2     -36.3813      1.00000
      3     -36.2633      1.00000
      4     -36.2631      1.00000
      5     -23.9364      1.00000
      6     -23.9330      1.00000
      7     -23.9300      1.00000
      8     -23.9281      1.00000
      9     -22.9161      1.00000
     10     -22.9114      1.00000
     11     -22.8986      1.00000
     12     -22.8984      1.00000
     13     -22.8813      1.00000
     14     -22.8805      1.00000
     15     -19.3855      1.00000
     16     -19.3045      1.00000
     17     -19.1797      1.00000
     18     -19.1543      1.00000
     19     -18.3796      1.00000
     20     -18.2823      1.00000
     21     -18.2352      1.00000
     22     -18.1434      1.00000
     23     -18.0341      1.00000
     24     -18.0122      1.00000
     25     -17.8947      1.00000
     26     -17.8858      1.00000
     27     -14.7913      1.00000
     28     -14.7825      1.00000
     29     -14.1585      1.00000
     30     -14.1455      1.00000
     31     -12.8579      1.00000
     32     -12.8329      1.00000
     33      -8.7405      1.00000
     34      -8.7343      1.00000
     35      -5.7399      1.00000
     36      -5.7223      1.00000
     37      -5.5043      1.00000
     38      -5.4367      1.00000
     39      -4.3992      1.00000
     40      -4.3353      1.00000
     41      -3.9774      1.00000
     42      -3.9448      1.00000
     43      -3.5435      1.00000
     44      -3.4594      1.00000
     45      -3.2557      1.00000
     46      -3.2395      1.00000
     47      -2.8664      1.00000
     48      -2.8407      1.00000
     49      -2.5860      1.00000
     50      -2.5777      1.00000
     51      -1.2004      0.00000
     52      -1.1692      0.00000
     53      -0.7328      0.00000
     54      -0.6659      0.00000
     55       0.5061      0.00000
     56       0.5159      0.00000
     57       1.1433      0.00000
     58       1.2121      0.00000
     59       1.6325      0.00000
     60       1.7131      0.00000
     61       1.8266      0.00000
     62       1.8736      0.00000
     63       2.2239      0.00000
     64       2.2731      0.00000
     65       2.4108      0.00000
     66       2.4730      0.00000
     67       2.8134      0.00000
     68       2.8451      0.00000
     69       3.2486      0.00000
     70       3.2604      0.00000
     71       3.3532      0.00000
     72       3.4057      0.00000

 k-point   123 :       0.1837    0.1837    0.0000
  band No.  band energies     occupation 
      1     -36.3842      1.00000
      2     -36.3828      1.00000
      3     -36.2640      1.00000
      4     -36.2638      1.00000
      5     -23.9364      1.00000
      6     -23.9331      1.00000
      7     -23.9301      1.00000
      8     -23.9282      1.00000
      9     -22.9158      1.00000
     10     -22.9111      1.00000
     11     -22.8985      1.00000
     12     -22.8983      1.00000
     13     -22.8817      1.00000
     14     -22.8810      1.00000
     15     -19.3837      1.00000
     16     -19.3039      1.00000
     17     -19.1711      1.00000
     18     -19.1475      1.00000
     19     -18.3775      1.00000
     20     -18.2820      1.00000
     21     -18.2219      1.00000
     22     -18.1378      1.00000
     23     -18.0279      1.00000
     24     -18.0048      1.00000
     25     -17.8906      1.00000
     26     -17.8839      1.00000
     27     -14.8345      1.00000
     28     -14.8254      1.00000
     29     -14.1750      1.00000
     30     -14.1617      1.00000
     31     -12.8644      1.00000
     32     -12.8400      1.00000
     33      -8.7003      1.00000
     34      -8.6947      1.00000
     35      -5.6723      1.00000
     36      -5.6511      1.00000
     37      -5.4645      1.00000
     38      -5.3924      1.00000
     39      -4.3490      1.00000
     40      -4.2804      1.00000
     41      -3.9326      1.00000
     42      -3.9000      1.00000
     43      -3.5394      1.00000
     44      -3.4510      1.00000
     45      -3.2747      1.00000
     46      -3.2587      1.00000
     47      -2.8648      1.00000
     48      -2.8363      1.00000
     49      -2.5912      1.00000
     50      -2.5829      1.00000
     51      -1.1840      0.00000
     52      -1.1527      0.00000
     53      -0.7988      0.00000
     54      -0.7332      0.00000
     55       0.5188      0.00000
     56       0.5297      0.00000
     57       1.1828      0.00000
     58       1.2513      0.00000
     59       1.6208      0.00000
     60       1.6700      0.00000
     61       1.8217      0.00000
     62       1.8389      0.00000
     63       2.1547      0.00000
     64       2.2014      0.00000
     65       2.4015      0.00000
     66       2.4556      0.00000
     67       2.7837      0.00000
     68       2.8174      0.00000
     69       3.2012      0.00000
     70       3.2128      0.00000
     71       3.3198      0.00000
     72       3.4396      0.00000

 k-point   124 :       0.1769    0.1769    0.0000
  band No.  band energies     occupation 
      1     -36.3857      1.00000
      2     -36.3844      1.00000
      3     -36.2647      1.00000
      4     -36.2645      1.00000
      5     -23.9363      1.00000
      6     -23.9331      1.00000
      7     -23.9301      1.00000
      8     -23.9283      1.00000
      9     -22.9156      1.00000
     10     -22.9108      1.00000
     11     -22.8984      1.00000
     12     -22.8981      1.00000
     13     -22.8822      1.00000
     14     -22.8814      1.00000
     15     -19.3820      1.00000
     16     -19.3034      1.00000
     17     -19.1621      1.00000
     18     -19.1404      1.00000
     19     -18.3755      1.00000
     20     -18.2817      1.00000
     21     -18.2082      1.00000
     22     -18.1317      1.00000
     23     -18.0218      1.00000
     24     -17.9970      1.00000
     25     -17.8870      1.00000
     26     -17.8819      1.00000
     27     -14.8774      1.00000
     28     -14.8681      1.00000
     29     -14.1923      1.00000
     30     -14.1787      1.00000
     31     -12.8710      1.00000
     32     -12.8472      1.00000
     33      -8.6610      1.00000
     34      -8.6560      1.00000
     35      -5.6003      1.00000
     36      -5.5747      1.00000
     37      -5.4225      1.00000
     38      -5.3445      1.00000
     39      -4.3036      1.00000
     40      -4.2299      1.00000
     41      -3.8843      1.00000
     42      -3.8514      1.00000
     43      -3.5328      1.00000
     44      -3.4403      1.00000
     45      -3.2948      1.00000
     46      -3.2790      1.00000
     47      -2.8628      1.00000
     48      -2.8318      1.00000
     49      -2.5967      1.00000
     50      -2.5885      1.00000
     51      -1.1676      0.00000
     52      -1.1362      0.00000
     53      -0.8634      0.00000
     54      -0.7992      0.00000
     55       0.5358      0.00000
     56       0.5481      0.00000
     57       1.2248      0.00000
     58       1.2913      0.00000
     59       1.5986      0.00000
     60       1.6180      0.00000
     61       1.7934      0.00000
     62       1.8304      0.00000
     63       2.0845      0.00000
     64       2.1292      0.00000
     65       2.3974      0.00000
     66       2.4422      0.00000
     67       2.7541      0.00000
     68       2.7886      0.00000
     69       3.1431      0.00000
     70       3.1573      0.00000
     71       3.3070      0.00000
     72       3.4165      0.00000

 k-point   125 :       0.1701    0.1701    0.0000
  band No.  band energies     occupation 
      1     -36.3873      1.00000
      2     -36.3860      1.00000
      3     -36.2654      1.00000
      4     -36.2651      1.00000
      5     -23.9363      1.00000
      6     -23.9332      1.00000
      7     -23.9301      1.00000
      8     -23.9284      1.00000
      9     -22.9153      1.00000
     10     -22.9105      1.00000
     11     -22.8984      1.00000
     12     -22.8980      1.00000
     13     -22.8827      1.00000
     14     -22.8819      1.00000
     15     -19.3802      1.00000
     16     -19.3031      1.00000
     17     -19.1526      1.00000
     18     -19.1330      1.00000
     19     -18.3734      1.00000
     20     -18.2815      1.00000
     21     -18.1943      1.00000
     22     -18.1249      1.00000
     23     -18.0156      1.00000
     24     -17.9888      1.00000
     25     -17.8841      1.00000
     26     -17.8795      1.00000
     27     -14.9199      1.00000
     28     -14.9105      1.00000
     29     -14.2103      1.00000
     30     -14.1964      1.00000
     31     -12.8780      1.00000
     32     -12.8547      1.00000
     33      -8.6231      1.00000
     34      -8.6186      1.00000
     35      -5.5244      1.00000
     36      -5.4935      1.00000
     37      -5.3775      1.00000
     38      -5.2923      1.00000
     39      -4.2634      1.00000
     40      -4.1843      1.00000
     41      -3.8333      1.00000
     42      -3.7996      1.00000
     43      -3.5229      1.00000
     44      -3.4269      1.00000
     45      -3.3153      1.00000
     46      -3.2997      1.00000
     47      -2.8609      1.00000
     48      -2.8274      1.00000
     49      -2.6024      1.00000
     50      -2.5944      1.00000
     51      -1.1517      0.00000
     52      -1.1200      0.00000
     53      -0.9259      0.00000
     54      -0.8634      0.00000
     55       0.5572      0.00000
     56       0.5709      0.00000
     57       1.2685      0.00000
     58       1.3289      0.00000
     59       1.5558      0.00000
     60       1.5762      0.00000
     61       1.7594      0.00000
     62       1.8252      0.00000
     63       2.0149      0.00000
     64       2.0575      0.00000
     65       2.3981      0.00000
     66       2.4333      0.00000
     67       2.7225      0.00000
     68       2.7566      0.00000
     69       3.0859      0.00000
     70       3.0997      0.00000
     71       3.2601      0.00000
     72       3.3720      0.00000

 k-point   126 :       0.1633    0.1633    0.0000
  band No.  band energies     occupation 
      1     -36.3889      1.00000
      2     -36.3876      1.00000
      3     -36.2661      1.00000
      4     -36.2658      1.00000
      5     -23.9362      1.00000
      6     -23.9333      1.00000
      7     -23.9301      1.00000
      8     -23.9285      1.00000
      9     -22.9150      1.00000
     10     -22.9102      1.00000
     11     -22.8984      1.00000
     12     -22.8978      1.00000
     13     -22.8832      1.00000
     14     -22.8824      1.00000
     15     -19.3785      1.00000
     16     -19.3030      1.00000
     17     -19.1429      1.00000
     18     -19.1255      1.00000
     19     -18.3713      1.00000
     20     -18.2813      1.00000
     21     -18.1801      1.00000
     22     -18.1176      1.00000
     23     -18.0093      1.00000
     24     -17.9803      1.00000
     25     -17.8819      1.00000
     26     -17.8766      1.00000
     27     -14.9618      1.00000
     28     -14.9523      1.00000
     29     -14.2289      1.00000
     30     -14.2148      1.00000
     31     -12.8851      1.00000
     32     -12.8624      1.00000
     33      -8.5867      1.00000
     34      -8.5828      1.00000
     35      -5.4452      1.00000
     36      -5.4085      1.00000
     37      -5.3284      1.00000
     38      -5.2348      1.00000
     39      -4.2291      1.00000
     40      -4.1441      1.00000
     41      -3.7803      1.00000
     42      -3.7458      1.00000
     43      -3.5096      1.00000
     44      -3.4109      1.00000
     45      -3.3355      1.00000
     46      -3.3201      1.00000
     47      -2.8590      1.00000
     48      -2.8235      1.00000
     49      -2.6082      1.00000
     50      -2.6004      1.00000
     51      -1.1374      0.00000
     52      -1.1055      0.00000
     53      -0.9850      0.00000
     54      -0.9247      0.00000
     55       0.5827      0.00000
     56       0.5982      0.00000
     57       1.3120      0.00000
     58       1.3568      0.00000
     59       1.4971      0.00000
     60       1.5506      0.00000
     61       1.7273      0.00000
     62       1.8142      0.00000
     63       1.9474      0.00000
     64       1.9869      0.00000
     65       2.4025      0.00000
     66       2.4289      0.00000
     67       2.6869      0.00000
     68       2.7195      0.00000
     69       3.0300      0.00000
     70       3.0501      0.00000
     71       3.2391      0.00000
     72       3.3179      0.00000

 k-point   127 :       0.1565    0.1565    0.0000
  band No.  band energies     occupation 
      1     -36.3905      1.00000
      2     -36.3892      1.00000
      3     -36.2668      1.00000
      4     -36.2666      1.00000
      5     -23.9361      1.00000
      6     -23.9334      1.00000
      7     -23.9301      1.00000
      8     -23.9285      1.00000
      9     -22.9147      1.00000
     10     -22.9099      1.00000
     11     -22.8984      1.00000
     12     -22.8976      1.00000
     13     -22.8836      1.00000
     14     -22.8829      1.00000
     15     -19.3767      1.00000
     16     -19.3032      1.00000
     17     -19.1330      1.00000
     18     -19.1177      1.00000
     19     -18.3690      1.00000
     20     -18.2812      1.00000
     21     -18.1658      1.00000
     22     -18.1098      1.00000
     23     -18.0029      1.00000
     24     -17.9717      1.00000
     25     -17.8802      1.00000
     26     -17.8735      1.00000
     27     -15.0030      1.00000
     28     -14.9935      1.00000
     29     -14.2478      1.00000
     30     -14.2336      1.00000
     31     -12.8924      1.00000
     32     -12.8702      1.00000
     33      -8.5522      1.00000
     34      -8.5489      1.00000
     35      -5.3636      1.00000
     36      -5.3224      1.00000
     37      -5.2723      1.00000
     38      -5.1710      1.00000
     39      -4.2011      1.00000
     40      -4.1095      1.00000
     41      -3.7262      1.00000
     42      -3.6911      1.00000
     43      -3.4928      1.00000
     44      -3.3943      1.00000
     45      -3.3532      1.00000
     46      -3.3382      1.00000
     47      -2.8574      1.00000
     48      -2.8201      1.00000
     49      -2.6141      1.00000
     50      -2.6066      1.00000
     51      -1.1289      0.00000
     52      -1.0972      0.00000
     53      -1.0344      0.00000
     54      -0.9803      0.00000
     55       0.6122      0.00000
     56       0.6298      0.00000
     57       1.3458      0.00000
     58       1.3678      0.00000
     59       1.4375      0.00000
     60       1.5409      0.00000
     61       1.6995      0.00000
     62       1.7961      0.00000
     63       1.8847      0.00000
     64       1.9183      0.00000
     65       2.4096      0.00000
     66       2.4284      0.00000
     67       2.6460      0.00000
     68       2.6764      0.00000
     69       2.9819      0.00000
     70       2.9972      0.00000
     71       3.1743      0.00000
     72       3.2196      0.00000

 k-point   128 :       0.1497    0.1497    0.0000
  band No.  band energies     occupation 
      1     -36.3921      1.00000
      2     -36.3908      1.00000
      3     -36.2675      1.00000
      4     -36.2673      1.00000
      5     -23.9361      1.00000
      6     -23.9335      1.00000
      7     -23.9301      1.00000
      8     -23.9286      1.00000
      9     -22.9144      1.00000
     10     -22.9097      1.00000
     11     -22.8983      1.00000
     12     -22.8975      1.00000
     13     -22.8841      1.00000
     14     -22.8834      1.00000
     15     -19.3750      1.00000
     16     -19.3035      1.00000
     17     -19.1230      1.00000
     18     -19.1099      1.00000
     19     -18.3666      1.00000
     20     -18.2811      1.00000
     21     -18.1515      1.00000
     22     -18.1016      1.00000
     23     -17.9963      1.00000
     24     -17.9629      1.00000
     25     -17.8789      1.00000
     26     -17.8704      1.00000
     27     -15.0434      1.00000
     28     -15.0339      1.00000
     29     -14.2671      1.00000
     30     -14.2528      1.00000
     31     -12.8999      1.00000
     32     -12.8782      1.00000
     33      -8.5199      1.00000
     34      -8.5171      1.00000
     35      -5.2804      1.00000
     36      -5.2454      1.00000
     37      -5.1990      1.00000
     38      -5.1000      1.00000
     39      -4.1792      1.00000
     40      -4.0805      1.00000
     41      -3.6720      1.00000
     42      -3.6368      1.00000
     43      -3.4735      1.00000
     44      -3.3890      1.00000
     45      -3.3613      1.00000
     46      -3.3465      1.00000
     47      -2.8563      1.00000
     48      -2.8174      1.00000
     49      -2.6199      1.00000
     50      -2.6128      1.00000
     51      -1.1445      0.00000
     52      -1.1065      0.00000
     53      -1.0570      0.00000
     54      -1.0180      0.00000
     55       0.6455      0.00000
     56       0.6655      0.00000
     57       1.3277      0.00000
     58       1.3685      0.00000
     59       1.4055      0.00000
     60       1.5448      0.00000
     61       1.6838      0.00000
     62       1.7688      0.00000
     63       1.8316      0.00000
     64       1.8529      0.00000
     65       2.4169      0.00000
     66       2.4308      0.00000
     67       2.6006      0.00000
     68       2.6290      0.00000
     69       2.9376      0.00000
     70       2.9526      0.00000
     71       3.0987      0.00000
     72       3.1659      0.00000

 k-point   129 :       0.1429    0.1429    0.0000
  band No.  band energies     occupation 
      1     -36.3938      1.00000
      2     -36.3924      1.00000
      3     -36.2682      1.00000
      4     -36.2680      1.00000
      5     -23.9360      1.00000
      6     -23.9336      1.00000
      7     -23.9301      1.00000
      8     -23.9286      1.00000
      9     -22.9140      1.00000
     10     -22.9094      1.00000
     11     -22.8983      1.00000
     12     -22.8973      1.00000
     13     -22.8846      1.00000
     14     -22.8839      1.00000
     15     -19.3733      1.00000
     16     -19.3040      1.00000
     17     -19.1130      1.00000
     18     -19.1020      1.00000
     19     -18.3641      1.00000
     20     -18.2810      1.00000
     21     -18.1371      1.00000
     22     -18.0929      1.00000
     23     -17.9895      1.00000
     24     -17.9540      1.00000
     25     -17.8777      1.00000
     26     -17.8674      1.00000
     27     -15.0828      1.00000
     28     -15.0733      1.00000
     29     -14.2866      1.00000
     30     -14.2722      1.00000
     31     -12.9074      1.00000
     32     -12.8864      1.00000
     33      -8.4900      1.00000
     34      -8.4876      1.00000
     35      -5.1965      1.00000
     36      -5.1803      1.00000
     37      -5.1060      1.00000
     38      -5.0211      1.00000
     39      -4.1633      1.00000
     40      -4.0568      1.00000
     41      -3.6191      1.00000
     42      -3.5854      1.00000
     43      -3.4539      1.00000
     44      -3.3999      1.00000
     45      -3.3655      1.00000
     46      -3.3295      1.00000
     47      -2.8555      1.00000
     48      -2.8156      1.00000
     49      -2.6255      1.00000
     50      -2.6190      1.00000
     51      -1.1898      0.00000
     52      -1.1399      0.00000
     53      -1.0571      0.00000
     54      -1.0219      0.00000
     55       0.6823      0.00000
     56       0.7053      0.00000
     57       1.2828      0.00000
     58       1.3121      0.00000
     59       1.4289      0.00000
     60       1.5383      0.00000
     61       1.6926      0.00000
     62       1.7304      0.00000
     63       1.7854      0.00000
     64       1.8034      0.00000
     65       2.4198      0.00000
     66       2.4335      0.00000
     67       2.5543      0.00000
     68       2.5818      0.00000
     69       2.8955      0.00000
     70       2.9108      0.00000
     71       3.0463      0.00000
     72       3.1061      0.00000

 k-point   130 :       0.1361    0.1361    0.0000
  band No.  band energies     occupation 
      1     -36.3954      1.00000
      2     -36.3941      1.00000
      3     -36.2689      1.00000
      4     -36.2687      1.00000
      5     -23.9359      1.00000
      6     -23.9338      1.00000
      7     -23.9301      1.00000
      8     -23.9286      1.00000
      9     -22.9137      1.00000
     10     -22.9092      1.00000
     11     -22.8981      1.00000
     12     -22.8972      1.00000
     13     -22.8851      1.00000
     14     -22.8844      1.00000
     15     -19.3716      1.00000
     16     -19.3047      1.00000
     17     -19.1030      1.00000
     18     -19.0941      1.00000
     19     -18.3615      1.00000
     20     -18.2810      1.00000
     21     -18.1228      1.00000
     22     -18.0838      1.00000
     23     -17.9827      1.00000
     24     -17.9450      1.00000
     25     -17.8768      1.00000
     26     -17.8645      1.00000
     27     -15.1211      1.00000
     28     -15.1117      1.00000
     29     -14.3062      1.00000
     30     -14.2917      1.00000
     31     -12.9151      1.00000
     32     -12.8947      1.00000
     33      -8.4626      1.00000
     34      -8.4605      1.00000
     35      -5.1181      1.00000
     36      -5.1108      1.00000
     37      -5.0039      1.00000
     38      -4.9344      1.00000
     39      -4.1528      1.00000
     40      -4.0378      1.00000
     41      -3.5705      1.00000
     42      -3.5416      1.00000
     43      -3.4358      1.00000
     44      -3.4098      1.00000
     45      -3.3594      1.00000
     46      -3.3029      1.00000
     47      -2.8552      1.00000
     48      -2.8146      1.00000
     49      -2.6309      1.00000
     50      -2.6250      1.00000
     51      -1.2427      0.00000
     52      -1.1893      0.00000
     53      -1.0467      0.00000
     54      -1.0105      0.00000
     55       0.7220      0.00000
     56       0.7488      0.00000
     57       1.2291      0.00000
     58       1.2535      0.00000
     59       1.4377      0.00000
     60       1.5124      0.00000
     61       1.6875      0.00000
     62       1.7060      0.00000
     63       1.7486      0.00000
     64       1.7890      0.00000
     65       2.4096      0.00000
     66       2.4273      0.00000
     67       2.5167      0.00000
     68       2.5444      0.00000
     69       2.8557      0.00000
     70       2.8861      0.00000
     71       2.9804      0.00000
     72       3.0677      0.00000

 k-point   131 :       0.1293    0.1293    0.0000
  band No.  band energies     occupation 
      1     -36.3969      1.00000
      2     -36.3956      1.00000
      3     -36.2697      1.00000
      4     -36.2694      1.00000
      5     -23.9359      1.00000
      6     -23.9339      1.00000
      7     -23.9302      1.00000
      8     -23.9287      1.00000
      9     -22.9134      1.00000
     10     -22.9091      1.00000
     11     -22.8980      1.00000
     12     -22.8970      1.00000
     13     -22.8856      1.00000
     14     -22.8849      1.00000
     15     -19.3700      1.00000
     16     -19.3056      1.00000
     17     -19.0932      1.00000
     18     -19.0862      1.00000
     19     -18.3587      1.00000
     20     -18.2811      1.00000
     21     -18.1086      1.00000
     22     -18.0745      1.00000
     23     -17.9756      1.00000
     24     -17.9360      1.00000
     25     -17.8759      1.00000
     26     -17.8618      1.00000
     27     -15.1581      1.00000
     28     -15.1488      1.00000
     29     -14.3257      1.00000
     30     -14.3112      1.00000
     31     -12.9229      1.00000
     32     -12.9031      1.00000
     33      -8.4377      1.00000
     34      -8.4359      1.00000
     35      -5.0525      1.00000
     36      -5.0261      1.00000
     37      -4.8970      1.00000
     38      -4.8405      1.00000
     39      -4.1469      1.00000
     40      -4.0224      1.00000
     41      -3.5326      1.00000
     42      -3.5143      1.00000
     43      -3.4137      1.00000
     44      -3.4080      1.00000
     45      -3.3389      1.00000
     46      -3.2736      1.00000
     47      -2.8553      1.00000
     48      -2.8144      1.00000
     49      -2.6359      1.00000
     50      -2.6306      1.00000
     51      -1.2964      0.00000
     52      -1.2424      0.00000
     53      -1.0339      0.00000
     54      -0.9964      0.00000
     55       0.7638      0.00000
     56       0.7959      0.00000
     57       1.1730      0.00000
     58       1.1959      0.00000
     59       1.4230      0.00000
     60       1.4743      0.00000
     61       1.6453      0.00000
     62       1.6639      0.00000
     63       1.7748      0.00000
     64       1.8053      0.00000
     65       2.3784      0.00000
     66       2.3967      0.00000
     67       2.5027      0.00000
     68       2.5273      0.00000
     69       2.8107      0.00000
     70       2.8347      0.00000
     71       2.9033      0.00000
     72       2.9874      0.00000

 k-point   132 :       0.1224    0.1224    0.0000
  band No.  band energies     occupation 
      1     -36.3985      1.00000
      2     -36.3972      1.00000
      3     -36.2704      1.00000
      4     -36.2701      1.00000
      5     -23.9358      1.00000
      6     -23.9341      1.00000
      7     -23.9301      1.00000
      8     -23.9287      1.00000
      9     -22.9131      1.00000
     10     -22.9090      1.00000
     11     -22.8978      1.00000
     12     -22.8968      1.00000
     13     -22.8860      1.00000
     14     -22.8853      1.00000
     15     -19.3684      1.00000
     16     -19.3067      1.00000
     17     -19.0836      1.00000
     18     -19.0784      1.00000
     19     -18.3557      1.00000
     20     -18.2812      1.00000
     21     -18.0945      1.00000
     22     -18.0650      1.00000
     23     -17.9685      1.00000
     24     -17.9271      1.00000
     25     -17.8752      1.00000
     26     -17.8592      1.00000
     27     -15.1939      1.00000
     28     -15.1847      1.00000
     29     -14.3450      1.00000
     30     -14.3306      1.00000
     31     -12.9307      1.00000
     32     -12.9115      1.00000
     33      -8.4155      1.00000
     34      -8.4137      1.00000
     35      -4.9854      1.00000
     36      -4.9400      1.00000
     37      -4.7864      1.00000
     38      -4.7403      1.00000
     39      -4.1445      1.00000
     40      -4.0095      1.00000
     41      -3.5142      1.00000
     42      -3.5060      1.00000
     43      -3.3894      1.00000
     44      -3.3767      1.00000
     45      -3.3090      1.00000
     46      -3.2433      1.00000
     47      -2.8556      1.00000
     48      -2.8151      1.00000
     49      -2.6403      1.00000
     50      -2.6358      1.00000
     51      -1.3494      0.00000
     52      -1.2954      0.00000
     53      -1.0216      0.00000
     54      -0.9828      0.00000
     55       0.8061      0.00000
     56       0.8460      0.00000
     57       1.1180      0.00000
     58       1.1401      0.00000
     59       1.3891      0.00000
     60       1.4274      0.00000
     61       1.5971      0.00000
     62       1.6238      0.00000
     63       1.8025      0.00000
     64       1.8526      0.00000
     65       2.3311      0.00000
     66       2.3469      0.00000
     67       2.5016      0.00000
     68       2.5261      0.00000
     69       2.7645      0.00000
     70       2.7997      0.00000
     71       2.8101      0.00000
     72       2.9290      0.00000

 k-point   133 :       0.1156    0.1156    0.0000
  band No.  band energies     occupation 
      1     -36.4000      1.00000
      2     -36.3987      1.00000
      3     -36.2711      1.00000
      4     -36.2708      1.00000
      5     -23.9358      1.00000
      6     -23.9343      1.00000
      7     -23.9301      1.00000
      8     -23.9286      1.00000
      9     -22.9128      1.00000
     10     -22.9089      1.00000
     11     -22.8976      1.00000
     12     -22.8966      1.00000
     13     -22.8865      1.00000
     14     -22.8858      1.00000
     15     -19.3668      1.00000
     16     -19.3080      1.00000
     17     -19.0743      1.00000
     18     -19.0707      1.00000
     19     -18.3526      1.00000
     20     -18.2813      1.00000
     21     -18.0807      1.00000
     22     -18.0554      1.00000
     23     -17.9614      1.00000
     24     -17.9182      1.00000
     25     -17.8746      1.00000
     26     -17.8566      1.00000
     27     -15.2282      1.00000
     28     -15.2192      1.00000
     29     -14.3640      1.00000
     30     -14.3498      1.00000
     31     -12.9385      1.00000
     32     -12.9200      1.00000
     33      -8.3958      1.00000
     34      -8.3939      1.00000
     35      -4.9170      1.00000
     36      -4.8529      1.00000
     37      -4.6732      1.00000
     38      -4.6352      1.00000
     39      -4.1443      1.00000
     40      -3.9976      1.00000
     41      -3.5134      1.00000
     42      -3.5063      1.00000
     43      -3.3523      1.00000
     44      -3.3353      1.00000
     45      -3.2744      1.00000
     46      -3.2131      1.00000
     47      -2.8561      1.00000
     48      -2.8166      1.00000
     49      -2.6440      1.00000
     50      -2.6403      1.00000
     51      -1.4012      0.00000
     52      -1.3475      0.00000
     53      -1.0115      0.00000
     54      -0.9714      0.00000
     55       0.8458      0.00000
     56       0.8984      0.00000
     57       1.0672      0.00000
     58       1.0879      0.00000
     59       1.3444      0.00000
     60       1.3743      0.00000
     61       1.5476      0.00000
     62       1.5887      0.00000
     63       1.8348      0.00000
     64       1.9076      0.00000
     65       2.2777      0.00000
     66       2.2912      0.00000
     67       2.4998      0.00000
     68       2.5255      0.00000
     69       2.7206      0.00000
     70       2.7297      0.00000
     71       2.7557      0.00000
     72       2.7803      0.00000

 k-point   134 :       0.1088    0.1088    0.0000
  band No.  band energies     occupation 
      1     -36.4015      1.00000
      2     -36.4002      1.00000
      3     -36.2717      1.00000
      4     -36.2715      1.00000
      5     -23.9357      1.00000
      6     -23.9345      1.00000
      7     -23.9301      1.00000
      8     -23.9286      1.00000
      9     -22.9126      1.00000
     10     -22.9089      1.00000
     11     -22.8974      1.00000
     12     -22.8964      1.00000
     13     -22.8869      1.00000
     14     -22.8863      1.00000
     15     -19.3653      1.00000
     16     -19.3094      1.00000
     17     -19.0653      1.00000
     18     -19.0631      1.00000
     19     -18.3494      1.00000
     20     -18.2816      1.00000
     21     -18.0672      1.00000
     22     -18.0457      1.00000
     23     -17.9542      1.00000
     24     -17.9096      1.00000
     25     -17.8741      1.00000
     26     -17.8542      1.00000
     27     -15.2610      1.00000
     28     -15.2522      1.00000
     29     -14.3825      1.00000
     30     -14.3686      1.00000
     31     -12.9462      1.00000
     32     -12.9284      1.00000
     33      -8.3786      1.00000
     34      -8.3765      1.00000
     35      -4.8483      1.00000
     36      -4.7652      1.00000
     37      -4.5584      1.00000
     38      -4.5264      1.00000
     39      -4.1444      1.00000
     40      -3.9850      1.00000
     41      -3.5189      1.00000
     42      -3.5090      1.00000
     43      -3.3089      1.00000
     44      -3.2934      1.00000
     45      -3.2376      1.00000
     46      -3.1834      1.00000
     47      -2.8566      1.00000
     48      -2.8187      1.00000
     49      -2.6467      1.00000
     50      -2.6441      1.00000
     51      -1.4518      0.00005
     52      -1.3984      0.00000
     53      -1.0048      0.00000
     54      -0.9634      0.00000
     55       0.8752      0.00000
     56       0.9513      0.00000
     57       1.0225      0.00000
     58       1.0450      0.00000
     59       1.2946      0.00000
     60       1.3189      0.00000
     61       1.5017      0.00000
     62       1.5551      0.00000
     63       1.8682      0.00000
     64       1.9616      0.00000
     65       2.2232      0.00000
     66       2.2348      0.00000
     67       2.4845      0.00000
     68       2.5170      0.00000
     69       2.6696      0.00000
     70       2.6971      0.00000
     71       2.7200      0.00000
     72       2.7388      0.00000

 k-point   135 :       0.1020    0.1020    0.0000
  band No.  band energies     occupation 
      1     -36.4030      1.00000
      2     -36.4017      1.00000
      3     -36.2724      1.00000
      4     -36.2721      1.00000
      5     -23.9357      1.00000
      6     -23.9347      1.00000
      7     -23.9301      1.00000
      8     -23.9286      1.00000
      9     -22.9123      1.00000
     10     -22.9089      1.00000
     11     -22.8971      1.00000
     12     -22.8962      1.00000
     13     -22.8873      1.00000
     14     -22.8867      1.00000
     15     -19.3638      1.00000
     16     -19.3109      1.00000
     17     -19.0569      1.00000
     18     -19.0555      1.00000
     19     -18.3460      1.00000
     20     -18.2818      1.00000
     21     -18.0540      1.00000
     22     -18.0360      1.00000
     23     -17.9472      1.00000
     24     -17.9014      1.00000
     25     -17.8734      1.00000
     26     -17.8518      1.00000
     27     -15.2922      1.00000
     28     -15.2837      1.00000
     29     -14.4006      1.00000
     30     -14.3870      1.00000
     31     -12.9538      1.00000
     32     -12.9368      1.00000
     33      -8.3636      1.00000
     34      -8.3614      1.00000
     35      -4.7812      1.00000
     36      -4.6782      1.00000
     37      -4.4437      1.00000
     38      -4.4149      1.00000
     39      -4.1417      1.00000
     40      -3.9698      1.00000
     41      -3.5248      1.00000
     42      -3.5115      1.00000
     43      -3.2649      1.00000
     44      -3.2534      1.00000
     45      -3.2002      1.00000
     46      -3.1544      1.00000
     47      -2.8570      1.00000
     48      -2.8214      1.00000
     49      -2.6486      1.00000
     50      -2.6468      1.00000
     51      -1.5009      0.00651
     52      -1.4478      0.00003
     53      -1.0028      0.00000
     54      -0.9601      0.00000
     55       0.8805      0.00000
     56       0.9722      0.00000
     57       1.0097      0.00000
     58       1.0249      0.00000
     59       1.2439      0.00000
     60       1.2675      0.00000
     61       1.4610      0.00000
     62       1.5231      0.00000
     63       1.8965      0.00000
     64       2.0100      0.00000
     65       2.1692      0.00000
     66       2.1812      0.00000
     67       2.4497      0.00000
     68       2.4955      0.00000
     69       2.6088      0.00000
     70       2.6397      0.00000
     71       2.7053      0.00000
     72       2.8016      0.00000

 k-point   136 :       0.0952    0.0952    0.0000
  band No.  band energies     occupation 
      1     -36.4043      1.00000
      2     -36.4031      1.00000
      3     -36.2730      1.00000
      4     -36.2728      1.00000
      5     -23.9357      1.00000
      6     -23.9348      1.00000
      7     -23.9300      1.00000
      8     -23.9286      1.00000
      9     -22.9121      1.00000
     10     -22.9090      1.00000
     11     -22.8968      1.00000
     12     -22.8960      1.00000
     13     -22.8877      1.00000
     14     -22.8872      1.00000
     15     -19.3624      1.00000
     16     -19.3126      1.00000
     17     -19.0493      1.00000
     18     -19.0479      1.00000
     19     -18.3426      1.00000
     20     -18.2822      1.00000
     21     -18.0412      1.00000
     22     -18.0263      1.00000
     23     -17.9404      1.00000
     24     -17.8940      1.00000
     25     -17.8722      1.00000
     26     -17.8494      1.00000
     27     -15.3217      1.00000
     28     -15.3135      1.00000
     29     -14.4180      1.00000
     30     -14.4048      1.00000
     31     -12.9612      1.00000
     32     -12.9451      1.00000
     33      -8.3508      1.00000
     34      -8.3483      1.00000
     35      -4.7175      1.00000
     36      -4.5949      1.00000
     37      -4.3330      1.00000
     38      -4.3014      1.00000
     39      -4.1301      1.00000
     40      -3.9496      1.00000
     41      -3.5294      1.00000
     42      -3.5120      1.00000
     43      -3.2236      1.00000
     44      -3.2163      1.00000
     45      -3.1631      1.00000
     46      -3.1259      1.00000
     47      -2.8572      1.00000
     48      -2.8244      1.00000
     49      -2.6495      1.00000
     50      -2.6480      1.00000
     51      -1.5486      0.12827
     52      -1.4957      0.00429
     53      -1.0066      0.00000
     54      -0.9626      0.00000
     55       0.8599      0.00000
     56       0.9320      0.00000
     57       1.0184      0.00000
     58       1.0472      0.00000
     59       1.2015      0.00000
     60       1.2344      0.00000
     61       1.4265      0.00000
     62       1.4936      0.00000
     63       1.9132      0.00000
     64       2.0469      0.00000
     65       2.1158      0.00000
     66       2.1344      0.00000
     67       2.4033      0.00000
     68       2.4512      0.00000
     69       2.5573      0.00000
     70       2.5842      0.00000
     71       2.7121      0.00000
     72       2.7930      0.00000

 k-point   137 :       0.0884    0.0884    0.0000
  band No.  band energies     occupation 
      1     -36.4057      1.00000
      2     -36.4044      1.00000
      3     -36.2737      1.00000
      4     -36.2734      1.00000
      5     -23.9357      1.00000
      6     -23.9350      1.00000
      7     -23.9300      1.00000
      8     -23.9286      1.00000
      9     -22.9120      1.00000
     10     -22.9091      1.00000
     11     -22.8964      1.00000
     12     -22.8958      1.00000
     13     -22.8880      1.00000
     14     -22.8876      1.00000
     15     -19.3610      1.00000
     16     -19.3144      1.00000
     17     -19.0423      1.00000
     18     -19.0403      1.00000
     19     -18.3392      1.00000
     20     -18.2826      1.00000
     21     -18.0289      1.00000
     22     -18.0168      1.00000
     23     -17.9339      1.00000
     24     -17.8883      1.00000
     25     -17.8699      1.00000
     26     -17.8470      1.00000
     27     -15.3495      1.00000
     28     -15.3416      1.00000
     29     -14.4346      1.00000
     30     -14.4219      1.00000
     31     -12.9684      1.00000
     32     -12.9532      1.00000
     33      -8.3398      1.00000
     34      -8.3373      1.00000
     35      -4.6595      1.00000
     36      -4.5203      1.00000
     37      -4.2358      1.00000
     38      -4.1862      1.00000
     39      -4.0968      1.00000
     40      -3.9220      1.00000
     41      -3.5320      1.00000
     42      -3.5096      1.00000
     43      -3.1882      1.00000
     44      -3.1811      1.00000
     45      -3.1270      1.00000
     46      -3.0973      1.00000
     47      -2.8569      1.00000
     48      -2.8276      1.00000
     49      -2.6498      1.00000
     50      -2.6477      1.00000
     51      -1.5948      0.56918
     52      -1.5422      0.09450
     53      -1.0172      0.00000
     54      -0.9721      0.00000
     55       0.8279      0.00000
     56       0.8912      0.00000
     57       0.9944      0.00000
     58       1.0429      0.00000
     59       1.1987      0.00000
     60       1.2354      0.00000
     61       1.3993      0.00000
     62       1.4677      0.00000
     63       1.9125      0.00000
     64       2.0597      0.00000
     65       2.0666      0.00000
     66       2.0978      0.00000
     67       2.3622      0.00000
     68       2.4115      0.00000
     69       2.5102      0.00000
     70       2.5318      0.00000
     71       2.7267      0.00000
     72       2.8060      0.00000

 k-point   138 :       0.0816    0.0816    0.0000
  band No.  band energies     occupation 
      1     -36.4069      1.00000
      2     -36.4056      1.00000
      3     -36.2742      1.00000
      4     -36.2740      1.00000
      5     -23.9358      1.00000
      6     -23.9352      1.00000
      7     -23.9299      1.00000
      8     -23.9286      1.00000
      9     -22.9118      1.00000
     10     -22.9092      1.00000
     11     -22.8961      1.00000
     12     -22.8955      1.00000
     13     -22.8883      1.00000
     14     -22.8879      1.00000
     15     -19.3595      1.00000
     16     -19.3163      1.00000
     17     -19.0358      1.00000
     18     -19.0331      1.00000
     19     -18.3357      1.00000
     20     -18.2831      1.00000
     21     -18.0171      1.00000
     22     -18.0074      1.00000
     23     -17.9278      1.00000
     24     -17.8851      1.00000
     25     -17.8656      1.00000
     26     -17.8444      1.00000
     27     -15.3754      1.00000
     28     -15.3679      1.00000
     29     -14.4504      1.00000
     30     -14.4383      1.00000
     31     -12.9754      1.00000
     32     -12.9610      1.00000
     33      -8.3307      1.00000
     34      -8.3280      1.00000
     35      -4.6096      1.00000
     36      -4.4620      1.00000
     37      -4.1610      1.00000
     38      -4.0703      1.00000
     39      -4.0269      1.00000
     40      -3.8851      1.00000
     41      -3.5323      1.00000
     42      -3.5037      1.00000
     43      -3.1601      1.00000
     44      -3.1477      1.00000
     45      -3.0919      1.00000
     46      -3.0678      1.00000
     47      -2.8559      1.00000
     48      -2.8306      1.00000
     49      -2.6490      1.00000
     50      -2.6460      1.00000
     51      -1.6398      0.92576
     52      -1.5873      0.48456
     53      -1.0353      0.00000
     54      -0.9893      0.00000
     55       0.7926      0.00000
     56       0.8511      0.00000
     57       0.9468      0.00000
     58       0.9926      0.00000
     59       1.2388      0.00000
     60       1.2658      0.00000
     61       1.3810      0.00000
     62       1.4470      0.00000
     63       1.8928      0.00000
     64       2.0130      0.00000
     65       2.0492      0.00000
     66       2.0703      0.00000
     67       2.3396      0.00000
     68       2.3814      0.00000
     69       2.4679      0.00000
     70       2.4862      0.00000
     71       2.7188      0.00000
     72       2.7774      0.00000

 k-point   139 :       0.0748    0.0748    0.0000
  band No.  band energies     occupation 
      1     -36.4081      1.00000
      2     -36.4068      1.00000
      3     -36.2748      1.00000
      4     -36.2745      1.00000
      5     -23.9358      1.00000
      6     -23.9354      1.00000
      7     -23.9299      1.00000
      8     -23.9285      1.00000
      9     -22.9117      1.00000
     10     -22.9094      1.00000
     11     -22.8957      1.00000
     12     -22.8953      1.00000
     13     -22.8886      1.00000
     14     -22.8883      1.00000
     15     -19.3581      1.00000
     16     -19.3183      1.00000
     17     -19.0297      1.00000
     18     -19.0265      1.00000
     19     -18.3322      1.00000
     20     -18.2837      1.00000
     21     -18.0058      1.00000
     22     -17.9982      1.00000
     23     -17.9224      1.00000
     24     -17.8841      1.00000
     25     -17.8596      1.00000
     26     -17.8417      1.00000
     27     -15.3994      1.00000
     28     -15.3924      1.00000
     29     -14.4652      1.00000
     30     -14.4538      1.00000
     31     -12.9820      1.00000
     32     -12.9687      1.00000
     33      -8.3230      1.00000
     34      -8.3204      1.00000
     35      -4.5690      1.00000
     36      -4.4254      1.00000
     37      -4.0929      1.00000
     38      -3.9562      1.00000
     39      -3.9320      1.00000
     40      -3.8376      1.00000
     41      -3.5299      1.00000
     42      -3.4935      1.00000
     43      -3.1378      1.00000
     44      -3.1180      1.00000
     45      -3.0584      1.00000
     46      -3.0375      1.00000
     47      -2.8538      1.00000
     48      -2.8332      1.00000
     49      -2.6471      1.00000
     50      -2.6432      1.00000
     51      -1.6834      0.99632
     52      -1.6311      0.88472
     53      -1.0613      0.00000
     54      -1.0147      0.00000
     55       0.7535      0.00000
     56       0.8075      0.00000
     57       0.8895      0.00000
     58       0.9302      0.00000
     59       1.2877      0.00000
     60       1.3100      0.00000
     61       1.3756      0.00000
     62       1.4337      0.00000
     63       1.8596      0.00000
     64       1.9662      0.00000
     65       2.0156      0.00000
     66       2.0397      0.00000
     67       2.3344      0.00000
     68       2.3549      0.00000
     69       2.4319      0.00000
     70       2.4458      0.00000
     71       2.6589      0.00000
     72       2.6914      0.00000

 k-point   140 :       0.0680    0.0680    0.0000
  band No.  band energies     occupation 
      1     -36.4092      1.00000
      2     -36.4079      1.00000
      3     -36.2753      1.00000
      4     -36.2750      1.00000
      5     -23.9359      1.00000
      6     -23.9355      1.00000
      7     -23.9298      1.00000
      8     -23.9285      1.00000
      9     -22.9117      1.00000
     10     -22.9096      1.00000
     11     -22.8954      1.00000
     12     -22.8950      1.00000
     13     -22.8889      1.00000
     14     -22.8886      1.00000
     15     -19.3567      1.00000
     16     -19.3204      1.00000
     17     -19.0239      1.00000
     18     -19.0204      1.00000
     19     -18.3287      1.00000
     20     -18.2844      1.00000
     21     -17.9952      1.00000
     22     -17.9892      1.00000
     23     -17.9176      1.00000
     24     -17.8844      1.00000
     25     -17.8530      1.00000
     26     -17.8387      1.00000
     27     -15.4215      1.00000
     28     -15.4150      1.00000
     29     -14.4790      1.00000
     30     -14.4683      1.00000
     31     -12.9882      1.00000
     32     -12.9759      1.00000
     33      -8.3168      1.00000
     34      -8.3142      1.00000
     35      -4.5382      1.00000
     36      -4.4087      1.00000
     37      -4.0167      1.00000
     38      -3.8468      1.00000
     39      -3.8314      1.00000
     40      -3.7793      1.00000
     41      -3.5243      1.00000
     42      -3.4781      1.00000
     43      -3.1200      1.00000
     44      -3.0918      1.00000
     45      -3.0271      1.00000
     46      -3.0070      1.00000
     47      -2.8496      1.00000
     48      -2.8344      1.00000
     49      -2.6442      1.00000
     50      -2.6397      1.00000
     51      -1.7259      0.99995
     52      -1.6736      0.99188
     53      -1.0950      0.00000
     54      -1.0481      0.00000
     55       0.7048      0.00000
     56       0.7521      0.00000
     57       0.8366      0.00000
     58       0.8741      0.00000
     59       1.3214      0.00000
     60       1.3567      0.00000
     61       1.3934      0.00000
     62       1.4332      0.00000
     63       1.8198      0.00000
     64       1.9228      0.00000
     65       1.9711      0.00000
     66       2.0082      0.00000
     67       2.3313      0.00000
     68       2.3397      0.00000
     69       2.4070      0.00000
     70       2.4122      0.00000
     71       2.6183      0.00000
     72       2.6553      0.00000

 k-point   141 :       0.0612    0.0612    0.0000
  band No.  band energies     occupation 
      1     -36.4102      1.00000
      2     -36.4089      1.00000
      3     -36.2758      1.00000
      4     -36.2755      1.00000
      5     -23.9359      1.00000
      6     -23.9357      1.00000
      7     -23.9297      1.00000
      8     -23.9285      1.00000
      9     -22.9116      1.00000
     10     -22.9098      1.00000
     11     -22.8951      1.00000
     12     -22.8948      1.00000
     13     -22.8892      1.00000
     14     -22.8889      1.00000
     15     -19.3553      1.00000
     16     -19.3225      1.00000
     17     -19.0186      1.00000
     18     -19.0149      1.00000
     19     -18.3252      1.00000
     20     -18.2852      1.00000
     21     -17.9851      1.00000
     22     -17.9805      1.00000
     23     -17.9137      1.00000
     24     -17.8856      1.00000
     25     -17.8464      1.00000
     26     -17.8356      1.00000
     27     -15.4416      1.00000
     28     -15.4356      1.00000
     29     -14.4917      1.00000
     30     -14.4818      1.00000
     31     -12.9940      1.00000
     32     -12.9828      1.00000
     33      -8.3117      1.00000
     34      -8.3091      1.00000
     35      -4.5163      1.00000
     36      -4.4052      1.00000
     37      -3.9341      1.00000
     38      -3.7454      1.00000
     39      -3.7370      1.00000
     40      -3.7096      1.00000
     41      -3.5133      1.00000
     42      -3.4559      1.00000
     43      -3.1056      1.00000
     44      -3.0689      1.00000
     45      -2.9989      1.00000
     46      -2.9779      1.00000
     47      -2.8418      1.00000
     48      -2.8332      1.00000
     49      -2.6404      1.00000
     50      -2.6358      1.00000
     51      -1.7675      1.00000
     52      -1.7153      0.99983
     53      -1.1355      0.00000
     54      -1.0890      0.00000
     55       0.6405      0.00000
     56       0.6807      0.00000
     57       0.7966      0.00000
     58       0.8326      0.00000
     59       1.3372      0.00000
     60       1.3855      0.00000
     61       1.4372      0.00000
     62       1.4570      0.00000
     63       1.7787      0.00000
     64       1.8829      0.00000
     65       1.9252      0.00000
     66       1.9792      0.00000
     67       2.3168      0.00000
     68       2.3280      0.00000
     69       2.3854      0.00000
     70       2.4009      0.00000
     71       2.5859      0.00000
     72       2.6182      0.00000

 k-point   142 :       0.0544    0.0544    0.0000
  band No.  band energies     occupation 
      1     -36.4111      1.00000
      2     -36.4099      1.00000
      3     -36.2762      1.00000
      4     -36.2759      1.00000
      5     -23.9360      1.00000
      6     -23.9358      1.00000
      7     -23.9296      1.00000
      8     -23.9285      1.00000
      9     -22.9116      1.00000
     10     -22.9100      1.00000
     11     -22.8947      1.00000
     12     -22.8945      1.00000
     13     -22.8894      1.00000
     14     -22.8892      1.00000
     15     -19.3539      1.00000
     16     -19.3246      1.00000
     17     -19.0137      1.00000
     18     -19.0100      1.00000
     19     -18.3218      1.00000
     20     -18.2862      1.00000
     21     -17.9756      1.00000
     22     -17.9721      1.00000
     23     -17.9107      1.00000
     24     -17.8873      1.00000
     25     -17.8401      1.00000
     26     -17.8324      1.00000
     27     -15.4596      1.00000
     28     -15.4542      1.00000
     29     -14.5032      1.00000
     30     -14.4942      1.00000
     31     -12.9993      1.00000
     32     -12.9892      1.00000
     33      -8.3076      1.00000
     34      -8.3052      1.00000
     35      -4.5017      1.00000
     36      -4.4092      1.00000
     37      -3.8514      1.00000
     38      -3.6606      1.00000
     39      -3.6536      1.00000
     40      -3.6300      1.00000
     41      -3.4913      1.00000
     42      -3.4251      1.00000
     43      -3.0931      1.00000
     44      -3.0493      1.00000
     45      -2.9747      1.00000
     46      -2.9523      1.00000
     47      -2.8288      1.00000
     48      -2.8272      1.00000
     49      -2.6358      1.00000
     50      -2.6317      1.00000
     51      -1.8083      1.00000
     52      -1.7563      1.00000
     53      -1.1815      0.00000
     54      -1.1361      0.00000
     55       0.5634      0.00000
     56       0.5980      0.00000
     57       0.7687      0.00000
     58       0.8028      0.00000
     59       1.3509      0.00000
     60       1.3972      0.00000
     61       1.4907      0.00000
     62       1.4970      0.00000
     63       1.7394      0.00000
     64       1.8459      0.00000
     65       1.8871      0.00000
     66       1.9543      0.00000
     67       2.2961      0.00000
     68       2.3114      0.00000
     69       2.3674      0.00000
     70       2.4012      0.00000
     71       2.5405      0.00000
     72       2.5731      0.00000

 k-point   143 :       0.0476    0.0476    0.0000
  band No.  band energies     occupation 
      1     -36.4119      1.00000
      2     -36.4107      1.00000
      3     -36.2766      1.00000
      4     -36.2763      1.00000
      5     -23.9360      1.00000
      6     -23.9359      1.00000
      7     -23.9295      1.00000
      8     -23.9285      1.00000
      9     -22.9115      1.00000
     10     -22.9102      1.00000
     11     -22.8944      1.00000
     12     -22.8943      1.00000
     13     -22.8896      1.00000
     14     -22.8894      1.00000
     15     -19.3524      1.00000
     16     -19.3268      1.00000
     17     -19.0093      1.00000
     18     -19.0057      1.00000
     19     -18.3185      1.00000
     20     -18.2872      1.00000
     21     -17.9668      1.00000
     22     -17.9640      1.00000
     23     -17.9086      1.00000
     24     -17.8894      1.00000
     25     -17.8342      1.00000
     26     -17.8290      1.00000
     27     -15.4756      1.00000
     28     -15.4707      1.00000
     29     -14.5134      1.00000
     30     -14.5054      1.00000
     31     -13.0040      1.00000
     32     -12.9952      1.00000
     33      -8.3043      1.00000
     34      -8.3021      1.00000
     35      -4.4927      1.00000
     36      -4.4169      1.00000
     37      -3.7755      1.00000
     38      -3.6042      1.00000
     39      -3.5724      1.00000
     40      -3.5562      1.00000
     41      -3.4473      1.00000
     42      -3.3843      1.00000
     43      -3.0815      1.00000
     44      -3.0333      1.00000
     45      -2.9550      1.00000
     46      -2.9322      1.00000
     47      -2.8147      1.00000
     48      -2.8082      1.00000
     49      -2.6307      1.00000
     50      -2.6275      1.00000
     51      -1.8486      1.00000
     52      -1.7969      1.00000
     53      -1.2311      0.00000
     54      -1.1875      0.00000
     55       0.4805      0.00000
     56       0.5109      0.00000
     57       0.7484      0.00000
     58       0.7794      0.00000
     59       1.3677      0.00000
     60       1.4076      0.00000
     61       1.5337      0.00000
     62       1.5437      0.00000
     63       1.7044      0.00000
     64       1.8122      0.00000
     65       1.8628      0.00000
     66       1.9352      0.00000
     67       2.2755      0.00000
     68       2.2946      0.00000
     69       2.3563      0.00000
     70       2.4042      0.00000
     71       2.5039      0.00000
     72       2.5383      0.00000

 k-point   144 :       0.0408    0.0408    0.0000
  band No.  band energies     occupation 
      1     -36.4127      1.00000
      2     -36.4114      1.00000
      3     -36.2769      1.00000
      4     -36.2767      1.00000
      5     -23.9361      1.00000
      6     -23.9360      1.00000
      7     -23.9294      1.00000
      8     -23.9286      1.00000
      9     -22.9115      1.00000
     10     -22.9104      1.00000
     11     -22.8942      1.00000
     12     -22.8941      1.00000
     13     -22.8898      1.00000
     14     -22.8896      1.00000
     15     -19.3509      1.00000
     16     -19.3289      1.00000
     17     -19.0054      1.00000
     18     -19.0020      1.00000
     19     -18.3154      1.00000
     20     -18.2884      1.00000
     21     -17.9587      1.00000
     22     -17.9563      1.00000
     23     -17.9074      1.00000
     24     -17.8920      1.00000
     25     -17.8290      1.00000
     26     -17.8257      1.00000
     27     -15.4894      1.00000
     28     -15.4852      1.00000
     29     -14.5223      1.00000
     30     -14.5153      1.00000
     31     -13.0081      1.00000
     32     -13.0005      1.00000
     33      -8.3018      1.00000
     34      -8.2998      1.00000
     35      -4.4873      1.00000
     36      -4.4264      1.00000
     37      -3.7122      1.00000
     38      -3.5741      1.00000
     39      -3.5005      1.00000
     40      -3.4859      1.00000
     41      -3.3836      1.00000
     42      -3.3350      1.00000
     43      -3.0702      1.00000
     44      -3.0217      1.00000
     45      -2.9388      1.00000
     46      -2.9176      1.00000
     47      -2.7932      1.00000
     48      -2.7816      1.00000
     49      -2.6251      1.00000
     50      -2.6233      1.00000
     51      -1.8884      1.00000
     52      -1.8374      1.00000
     53      -1.2818      0.00000
     54      -1.2410      0.00000
     55       0.3976      0.00000
     56       0.4242      0.00000
     57       0.7326      0.00000
     58       0.7601      0.00000
     59       1.3874      0.00000
     60       1.4198      0.00000
     61       1.5590      0.00000
     62       1.5884      0.00000
     63       1.6777      0.00000
     64       1.7847      0.00000
     65       1.8546      0.00000
     66       1.9228      0.00000
     67       2.2584      0.00000
     68       2.2799      0.00000
     69       2.3578      0.00000
     70       2.4081      0.00000
     71       2.4706      0.00000
     72       2.5430      0.00000

 k-point   145 :       0.0340    0.0340    0.0000
  band No.  band energies     occupation 
      1     -36.4133      1.00000
      2     -36.4120      1.00000
      3     -36.2772      1.00000
      4     -36.2769      1.00000
      5     -23.9362      1.00000
      6     -23.9361      1.00000
      7     -23.9293      1.00000
      8     -23.9286      1.00000
      9     -22.9115      1.00000
     10     -22.9105      1.00000
     11     -22.8939      1.00000
     12     -22.8939      1.00000
     13     -22.8899      1.00000
     14     -22.8898      1.00000
     15     -19.3494      1.00000
     16     -19.3310      1.00000
     17     -19.0020      1.00000
     18     -18.9990      1.00000
     19     -18.3123      1.00000
     20     -18.2898      1.00000
     21     -17.9511      1.00000
     22     -17.9491      1.00000
     23     -17.9071      1.00000
     24     -17.8949      1.00000
     25     -17.8245      1.00000
     26     -17.8226      1.00000
     27     -15.5011      1.00000
     28     -15.4976      1.00000
     29     -14.5298      1.00000
     30     -14.5239      1.00000
     31     -13.0115      1.00000
     32     -13.0052      1.00000
     33      -8.2998      1.00000
     34      -8.2981      1.00000
     35      -4.4844      1.00000
     36      -4.4362      1.00000
     37      -3.6636      1.00000
     38      -3.5603      1.00000
     39      -3.4367      1.00000
     40      -3.4182      1.00000
     41      -3.3172      1.00000
     42      -3.2815      1.00000
     43      -3.0591      1.00000
     44      -3.0158      1.00000
     45      -2.9237      1.00000
     46      -2.9063      1.00000
     47      -2.7648      1.00000
     48      -2.7514      1.00000
     49      -2.6191      1.00000
     50      -2.6179      1.00000
     51      -1.9277      1.00000
     52      -1.8779      1.00000
     53      -1.3309      0.00000
     54      -1.2937      0.00000
     55       0.3191      0.00000
     56       0.3419      0.00000
     57       0.7196      0.00000
     58       0.7439      0.00000
     59       1.4082      0.00000
     60       1.4332      0.00000
     61       1.5690      0.00000
     62       1.6104      0.00000
     63       1.6732      0.00000
     64       1.7656      0.00000
     65       1.8611      0.00000
     66       1.9171      0.00000
     67       2.2464      0.00000
     68       2.2685      0.00000
     69       2.3427      0.00000
     70       2.4060      0.00000
     71       2.4387      0.00000
     72       2.4888      0.00000

 k-point   146 :       0.0272    0.0272    0.0000
  band No.  band energies     occupation 
      1     -36.4138      1.00000
      2     -36.4125      1.00000
      3     -36.2775      1.00000
      4     -36.2772      1.00000
      5     -23.9362      1.00000
      6     -23.9362      1.00000
      7     -23.9292      1.00000
      8     -23.9286      1.00000
      9     -22.9114      1.00000
     10     -22.9107      1.00000
     11     -22.8938      1.00000
     12     -22.8937      1.00000
     13     -22.8900      1.00000
     14     -22.8899      1.00000
     15     -19.3478      1.00000
     16     -19.3331      1.00000
     17     -18.9991      1.00000
     18     -18.9966      1.00000
     19     -18.3093      1.00000
     20     -18.2913      1.00000
     21     -17.9440      1.00000
     22     -17.9424      1.00000
     23     -17.9076      1.00000
     24     -17.8982      1.00000
     25     -17.8207      1.00000
     26     -17.8197      1.00000
     27     -15.5107      1.00000
     28     -15.5078      1.00000
     29     -14.5359      1.00000
     30     -14.5311      1.00000
     31     -13.0142      1.00000
     32     -13.0093      1.00000
     33      -8.2983      1.00000
     34      -8.2969      1.00000
     35      -4.4826      1.00000
     36      -4.4457      1.00000
     37      -3.6283      1.00000
     38      -3.5538      1.00000
     39      -3.3819      1.00000
     40      -3.3587      1.00000
     41      -3.2561      1.00000
     42      -3.2285      1.00000
     43      -3.0497      1.00000
     44      -3.0160      1.00000
     45      -2.9073      1.00000
     46      -2.8947      1.00000
     47      -2.7338      1.00000
     48      -2.7218      1.00000
     49      -2.6122      1.00000
     50      -2.6102      1.00000
     51      -1.9655      1.00000
     52      -1.9178      1.00000
     53      -1.3755      0.00000
     54      -1.3428      0.00000
     55       0.2488      0.00000
     56       0.2676      0.00000
     57       0.7089      0.00000
     58       0.7306      0.00000
     59       1.4278      0.00000
     60       1.4466      0.00000
     61       1.5671      0.00000
     62       1.6012      0.00000
     63       1.6976      0.00000
     64       1.7551      0.00000
     65       1.8771      0.00000
     66       1.9172      0.00000
     67       2.2407      0.00000
     68       2.2625      0.00000
     69       2.3370      0.00000
     70       2.3924      0.00000
     71       2.4178      0.00000
     72       2.4551      0.00000

 k-point   147 :       0.0204    0.0204    0.0000
  band No.  band energies     occupation 
      1     -36.4142      1.00000
      2     -36.4129      1.00000
      3     -36.2777      1.00000
      4     -36.2774      1.00000
      5     -23.9362      1.00000
      6     -23.9362      1.00000
      7     -23.9291      1.00000
      8     -23.9287      1.00000
      9     -22.9114      1.00000
     10     -22.9108      1.00000
     11     -22.8936      1.00000
     12     -22.8936      1.00000
     13     -22.8901      1.00000
     14     -22.8900      1.00000
     15     -19.3461      1.00000
     16     -19.3352      1.00000
     17     -18.9967      1.00000
     18     -18.9948      1.00000
     19     -18.3066      1.00000
     20     -18.2929      1.00000
     21     -17.9376      1.00000
     22     -17.9365      1.00000
     23     -17.9087      1.00000
     24     -17.9018      1.00000
     25     -17.8178      1.00000
     26     -17.8173      1.00000
     27     -15.5180      1.00000
     28     -15.5159      1.00000
     29     -14.5405      1.00000
     30     -14.5369      1.00000
     31     -13.0163      1.00000
     32     -13.0126      1.00000
     33      -8.2972      1.00000
     34      -8.2962      1.00000
     35      -4.4811      1.00000
     36      -4.4544      1.00000
     37      -3.6028      1.00000
     38      -3.5515      1.00000
     39      -3.3379      1.00000
     40      -3.3137      1.00000
     41      -3.2009      1.00000
     42      -3.1799      1.00000
     43      -3.0449      1.00000
     44      -3.0224      1.00000
     45      -2.8887      1.00000
     46      -2.8811      1.00000
     47      -2.7062      1.00000
     48      -2.6980      1.00000
     49      -2.6020      1.00000
     50      -2.6001      1.00000
     51      -2.0002      1.00000
     52      -1.9557      1.00000
     53      -1.4127      0.00000
     54      -1.3853      0.00000
     55       0.1902      0.00000
     56       0.2047      0.00000
     57       0.7003      0.00000
     58       0.7202      0.00000
     59       1.4444      0.00000
     60       1.4584      0.00000
     61       1.5599      0.00000
     62       1.5852      0.00000
     63       1.7251      0.00000
     64       1.7521      0.00000
     65       1.8950      0.00000
     66       1.9216      0.00000
     67       2.2418      0.00000
     68       2.2640      0.00000
     69       2.3539      0.00000
     70       2.3775      0.00000
     71       2.4232      0.00000
     72       2.5379      0.00000

 k-point   148 :       0.0136    0.0136    0.0000
  band No.  band energies     occupation 
      1     -36.4145      1.00000
      2     -36.4132      1.00000
      3     -36.2778      1.00000
      4     -36.2775      1.00000
      5     -23.9363      1.00000
      6     -23.9363      1.00000
      7     -23.9290      1.00000
      8     -23.9287      1.00000
      9     -22.9113      1.00000
     10     -22.9110      1.00000
     11     -22.8935      1.00000
     12     -22.8935      1.00000
     13     -22.8902      1.00000
     14     -22.8901      1.00000
     15     -19.3444      1.00000
     16     -19.3372      1.00000
     17     -18.9949      1.00000
     18     -18.9936      1.00000
     19     -18.3039      1.00000
     20     -18.2948      1.00000
     21     -17.9320      1.00000
     22     -17.9314      1.00000
     23     -17.9102      1.00000
     24     -17.9055      1.00000
     25     -17.8156      1.00000
     26     -17.8155      1.00000
     27     -15.5232      1.00000
     28     -15.5218      1.00000
     29     -14.5437      1.00000
     30     -14.5413      1.00000
     31     -13.0176      1.00000
     32     -13.0152      1.00000
     33      -8.2964      1.00000
     34      -8.2957      1.00000
     35      -4.4794      1.00000
     36      -4.4619      1.00000
     37      -3.5842      1.00000
     38      -3.5522      1.00000
     39      -3.3055      1.00000
     40      -3.2857      1.00000
     41      -3.1514      1.00000
     42      -3.1381      1.00000
     43      -3.0472      1.00000
     44      -3.0345      1.00000
     45      -2.8698      1.00000
     46      -2.8667      1.00000
     47      -2.6869      1.00000
     48      -2.6831      1.00000
     49      -2.5886      1.00000
     50      -2.5879      1.00000
     51      -2.0287      1.00000
     52      -1.9887      1.00000
     53      -1.4401      0.00001
     54      -1.4188      0.00000
     55       0.1465      0.00000
     56       0.1563      0.00000
     57       0.6937      0.00000
     58       0.7130      0.00000
     59       1.4571      0.00000
     60       1.4673      0.00000
     61       1.5526      0.00000
     62       1.5709      0.00000
     63       1.7457      0.00000
     64       1.7544      0.00000
     65       1.9098      0.00000
     66       1.9276      0.00000
     67       2.2489      0.00000
     68       2.2678      0.00000
     69       2.3227      0.00000
     70       2.3433      0.00000
     71       2.4004      0.00000
     72       2.4125      0.00000

 k-point   149 :       0.0068    0.0068    0.0000
  band No.  band energies     occupation 
      1     -36.4146      1.00000
      2     -36.4134      1.00000
      3     -36.2779      1.00000
      4     -36.2776      1.00000
      5     -23.9363      1.00000
      6     -23.9363      1.00000
      7     -23.9289      1.00000
      8     -23.9288      1.00000
      9     -22.9113      1.00000
     10     -22.9111      1.00000
     11     -22.8934      1.00000
     12     -22.8934      1.00000
     13     -22.8902      1.00000
     14     -22.8902      1.00000
     15     -19.3427      1.00000
     16     -19.3391      1.00000
     17     -18.9937      1.00000
     18     -18.9931      1.00000
     19     -18.3014      1.00000
     20     -18.2967      1.00000
     21     -17.9278      1.00000
     22     -17.9277      1.00000
     23     -17.9115      1.00000
     24     -17.9089      1.00000
     25     -17.8144      1.00000
     26     -17.8144      1.00000
     27     -15.5262      1.00000
     28     -15.5254      1.00000
     29     -14.5453      1.00000
     30     -14.5441      1.00000
     31     -13.0184      1.00000
     32     -13.0168      1.00000
     33      -8.2959      1.00000
     34      -8.2955      1.00000
     35      -4.4769      1.00000
     36      -4.4680      1.00000
     37      -3.5707      1.00000
     38      -3.5556      1.00000
     39      -3.2842      1.00000
     40      -3.2730      1.00000
     41      -3.1097      1.00000
     42      -3.1037      1.00000
     43      -3.0579      1.00000
     44      -3.0523      1.00000
     45      -2.8554      1.00000
     46      -2.8549      1.00000
     47      -2.6770      1.00000
     48      -2.6760      1.00000
     49      -2.5768      1.00000
     50      -2.5768      1.00000
     51      -2.0472      1.00000
     52      -2.0124      1.00000
     53      -1.4560      0.00009
     54      -1.4409      0.00001
     55       0.1202      0.00000
     56       0.1251      0.00000
     57       0.6892      0.00000
     58       0.7089      0.00000
     59       1.4662      0.00000
     60       1.4718      0.00000
     61       1.5477      0.00000
     62       1.5610      0.00000
     63       1.7574      0.00000
     64       1.7585      0.00000
     65       1.9202      0.00000
     66       1.9314      0.00000
     67       2.2611      0.00000
     68       2.2774      0.00000
     69       2.3177      0.00000
     70       2.3277      0.00000
     71       2.3959      0.00000
     72       2.4462      0.00000

 k-point   150 :       0.0000    0.0000    0.0000
  band No.  band energies     occupation 
      1     -36.4147      1.00000
      2     -36.4134      1.00000
      3     -36.2779      1.00000
      4     -36.2776      1.00000
      5     -23.9363      1.00000
      6     -23.9363      1.00000
      7     -23.9289      1.00000
      8     -23.9288      1.00000
      9     -22.9112      1.00000
     10     -22.9112      1.00000
     11     -22.8934      1.00000
     12     -22.8934      1.00000
     13     -22.8902      1.00000
     14     -22.8902      1.00000
     15     -19.3414      1.00000
     16     -19.3405      1.00000
     17     -18.9932      1.00000
     18     -18.9930      1.00000
     19     -18.2993      1.00000
     20     -18.2987      1.00000
     21     -17.9261      1.00000
     22     -17.9260      1.00000
     23     -17.9116      1.00000
     24     -17.9111      1.00000
     25     -17.8140      1.00000
     26     -17.8140      1.00000
     27     -15.5270      1.00000
     28     -15.5268      1.00000
     29     -14.5456      1.00000
     30     -14.5454      1.00000
     31     -13.0188      1.00000
     32     -13.0170      1.00000
     33      -8.2957      1.00000
     34      -8.2955      1.00000
     35      -4.4735      1.00000
     36      -4.4727      1.00000
     37      -3.5636      1.00000
     38      -3.5594      1.00000
     39      -3.2737      1.00000
     40      -3.2726      1.00000
     41      -3.0771      1.00000
     42      -3.0770      1.00000
     43      -3.0768      1.00000
     44      -3.0767      1.00000
     45      -2.8502      1.00000
     46      -2.8500      1.00000
     47      -2.6742      1.00000
     48      -2.6740      1.00000
     49      -2.5723      1.00000
     50      -2.5721      1.00000
     51      -2.0525      1.00000
     52      -2.0223      1.00000
     53      -1.4599      0.00014
     54      -1.4499      0.00004
     55       0.1122      0.00000
     56       0.1135      0.00000
     57       0.6872      0.00000
     58       0.7082      0.00000
     59       1.4712      0.00000
     60       1.4714      0.00000
     61       1.5447      0.00000
     62       1.5585      0.00000
     63       1.7608      0.00000
     64       1.7608      0.00000
     65       1.9254      0.00000
     66       1.9312      0.00000
     67       2.2729      0.00000
     68       2.2778      0.00000
     69       2.3082      0.00000
     70       2.3098      0.00000
     71       2.3918      0.00000
     72       2.4390      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
 
 soft charge-density along one line, spin component           2
         0         1         2         3         4         5         6         7         8         9
 total charge-density along one line
 
 soft charge-density along one line, spin component           3
         0         1         2         3         4         5         6         7         8         9
 total charge-density along one line
 
 soft charge-density along one line, spin component           4
         0         1         2         3         4         5         6         7         8         9
 total charge-density along one line
 
 pseudopotential strength for first ion, spin component:           1
-23.410   0.000  -0.000   0.000   0.000   0.000   0.006   0.000   0.000   0.415   6.681   0.000   0.000   0.000  -0.000   0.000
 -0.000   0.000 -23.407   0.000  -0.000   0.000  -0.000   0.207   0.006   0.000   0.000   0.000   6.680   0.000   0.000   0.000
  0.000   0.000  -0.000   0.000 -23.418   0.000  -0.000   0.000   0.000   0.000  -0.000   0.000   0.000   0.000   6.684   0.000
  0.006   0.000  -0.000  -0.207  -0.000   0.000 -23.407   0.000  -0.000   0.000  -0.003   0.000   0.000   0.126   0.000   0.000
  0.000  -0.415   0.006   0.000   0.000   0.000  -0.000   0.000 -23.410   0.000  -0.000   0.252  -0.003   0.000  -0.000   0.000
  6.681   0.000   0.000   0.000  -0.000   0.000  -0.003   0.000  -0.000  -0.252   2.798   0.000  -0.000   0.000   0.000   0.000
  0.000   0.000   6.680   0.000   0.000   0.000   0.000  -0.126  -0.003   0.000  -0.000   0.000   2.798   0.000  -0.000   0.000
 -0.000   0.000   0.000   0.000   6.684   0.000   0.000   0.000  -0.000   0.000   0.000   0.000  -0.000   0.000   2.797   0.000
 -0.003   0.000   0.000   0.126   0.000   0.000   6.680   0.000   0.000   0.000   0.000   0.000  -0.000  -0.077  -0.000   0.000
 -0.000   0.252  -0.003   0.000  -0.000   0.000   0.000   0.000   6.681   0.000  -0.000  -0.154   0.000   0.000   0.000   0.000
  0.000   0.000   0.000   0.000  -0.001   0.000   0.000   0.000   0.000   0.000  -0.000   0.000   0.000   0.000  -0.001   0.000
 -0.000   0.000  -0.000   0.000   0.001   0.000  -0.000   0.000   0.000   0.000   0.000   0.000  -0.000   0.000   0.001   0.000
  0.000   0.000   0.001   0.000  -0.000   0.000  -0.000   0.000   0.001   0.000  -0.000   0.000   0.001   0.000  -0.000   0.000
 -0.000   0.000   0.000   0.000   0.001   0.000   0.000   0.000  -0.000   0.000  -0.000   0.000  -0.000   0.000   0.002   0.000
  0.001   0.000  -0.000   0.000  -0.000   0.000   0.001   0.000   0.000   0.000  -0.000   0.000  -0.000   0.000   0.000   0.000
  0.000   0.000   0.002   0.000  -0.000   0.000  -0.000   0.000   0.001   0.000  -0.000   0.000   0.002   0.000  -0.000   0.000
 -0.000   0.000   0.000   0.000   0.001   0.000   0.000   0.000  -0.000   0.000  -0.000   0.000  -0.000   0.000   0.003   0.000
  0.001   0.000  -0.000   0.000  -0.000   0.000   0.002   0.000   0.000   0.000  -0.001   0.000  -0.000   0.000   0.000   0.000
 pseudopotential strength for first ion, spin component:           2
 -0.000   0.000   0.207  -0.000   0.000   0.000   0.000  -0.207   0.000   0.000   0.000  -0.000  -0.126   0.000  -0.000  -0.000
 -0.207  -0.000   0.000  -0.000   0.000  -0.359  -0.000   0.000  -0.000  -0.207   0.126   0.000  -0.000   0.000  -0.000   0.219
  0.000   0.000   0.000   0.359   0.000  -0.000  -0.359   0.000  -0.000   0.000  -0.000  -0.000  -0.000  -0.219  -0.000   0.000
  0.000   0.207  -0.000   0.000   0.359   0.000   0.000  -0.000  -0.207   0.000  -0.000  -0.126   0.000  -0.000  -0.219  -0.000
  0.000   0.000  -0.000   0.207  -0.000   0.000   0.207   0.000  -0.000   0.000  -0.000  -0.000   0.000  -0.126   0.000  -0.000
  0.000  -0.000  -0.126   0.000  -0.000  -0.000  -0.000   0.126  -0.000  -0.000  -0.000  -0.000   0.077   0.000   0.000  -0.000
  0.126   0.000  -0.000   0.000  -0.000   0.219   0.000  -0.000   0.000   0.126  -0.077   0.000   0.000  -0.000  -0.000  -0.133
 -0.000  -0.000  -0.000  -0.219  -0.000   0.000   0.219  -0.000   0.000  -0.000   0.000  -0.000  -0.000   0.133   0.000  -0.000
 -0.000  -0.126   0.000  -0.000  -0.219  -0.000  -0.000   0.000   0.126  -0.000   0.000   0.077  -0.000  -0.000   0.133  -0.000
 -0.000  -0.000   0.000  -0.126   0.000  -0.000  -0.126  -0.000   0.000  -0.000  -0.000  -0.000  -0.000   0.077   0.000  -0.000
 -0.000   0.000   0.000   0.000   0.000  -0.000   0.000  -0.000   0.000  -0.000   0.000  -0.000  -0.000  -0.000  -0.000   0.000
  0.000  -0.000  -0.000  -0.000  -0.000   0.000  -0.000   0.000  -0.000   0.000  -0.000   0.000   0.000   0.000   0.000  -0.000
  0.000  -0.000   0.000  -0.000  -0.000   0.000   0.000  -0.000  -0.000   0.000   0.000  -0.000  -0.000   0.000   0.000   0.000
  0.000  -0.000   0.000  -0.000   0.000  -0.000   0.000  -0.000  -0.000   0.000  -0.000   0.000   0.000   0.000   0.000  -0.000
  0.000   0.000   0.000  -0.000  -0.000   0.000   0.000  -0.000   0.000  -0.000   0.000  -0.000  -0.000   0.000   0.000  -0.000
  0.000  -0.000   0.000  -0.000  -0.000  -0.000   0.000  -0.000  -0.000   0.000   0.000  -0.000  -0.000   0.000   0.000   0.000
  0.000  -0.000   0.000  -0.000   0.000  -0.000   0.000  -0.000  -0.000   0.000  -0.000   0.000   0.000   0.000   0.000  -0.000
  0.000   0.000   0.000  -0.000  -0.000   0.000   0.000  -0.000   0.000  -0.000   0.000  -0.000  -0.000   0.000   0.000  -0.000
 pseudopotential strength for first ion, spin component:           3
 -0.000  -0.000  -0.207   0.000   0.000  -0.000   0.000  -0.207   0.000  -0.000   0.000   0.000   0.126  -0.000  -0.000   0.000
  0.207   0.000   0.000   0.000   0.000  -0.359  -0.000  -0.000  -0.000  -0.207  -0.126  -0.000  -0.000  -0.000  -0.000   0.219
  0.000  -0.000   0.000   0.359   0.000   0.000   0.359  -0.000  -0.000  -0.000  -0.000   0.000  -0.000  -0.219  -0.000  -0.000
  0.000   0.207  -0.000  -0.000  -0.359  -0.000   0.000   0.000   0.207  -0.000  -0.000  -0.126   0.000   0.000   0.219   0.000
  0.000  -0.000  -0.000   0.207  -0.000  -0.000  -0.207  -0.000  -0.000  -0.000  -0.000   0.000   0.000  -0.126   0.000   0.000
  0.000   0.000   0.126  -0.000  -0.000   0.000  -0.000   0.126  -0.000   0.000  -0.000   0.000  -0.077  -0.000   0.000   0.000
 -0.126  -0.000  -0.000  -0.000  -0.000   0.219   0.000   0.000   0.000   0.126   0.077  -0.000   0.000   0.000  -0.000  -0.133
 -0.000   0.000  -0.000  -0.219  -0.000  -0.000  -0.219   0.000   0.000   0.000   0.000   0.000  -0.000   0.133   0.000   0.000
 -0.000  -0.126   0.000   0.000   0.219   0.000  -0.000  -0.000  -0.126   0.000   0.000   0.077  -0.000   0.000  -0.133   0.000
 -0.000   0.000   0.000  -0.126   0.000   0.000   0.126   0.000   0.000   0.000  -0.000   0.000  -0.000   0.077   0.000   0.000
 -0.000  -0.000   0.000  -0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000  -0.000   0.000  -0.000  -0.000
  0.000   0.000  -0.000   0.000  -0.000  -0.000  -0.000  -0.000  -0.000  -0.000  -0.000  -0.000   0.000  -0.000   0.000   0.000
  0.000   0.000   0.000   0.000  -0.000  -0.000   0.000   0.000  -0.000  -0.000   0.000   0.000  -0.000  -0.000   0.000  -0.000
  0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000  -0.000  -0.000  -0.000  -0.000   0.000  -0.000   0.000   0.000
  0.000  -0.000   0.000   0.000  -0.000  -0.000   0.000   0.000   0.000   0.000   0.000   0.000  -0.000  -0.000   0.000   0.000
  0.000   0.000   0.000   0.000  -0.000   0.000   0.000   0.000  -0.000  -0.000   0.000   0.000  -0.000  -0.000   0.000  -0.000
  0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000  -0.000  -0.000  -0.000  -0.000   0.000  -0.000   0.000   0.000
  0.000  -0.000   0.000   0.000  -0.000  -0.000   0.000   0.000   0.000   0.000   0.000   0.000  -0.000  -0.000   0.000   0.000
 pseudopotential strength for first ion, spin component:           4
-23.410   0.000  -0.000   0.000   0.000   0.000   0.006   0.000  -0.000  -0.415   6.681   0.000   0.000   0.000  -0.000   0.000
 -0.000   0.000 -23.407   0.000  -0.000   0.000   0.000  -0.207   0.006   0.000   0.000   0.000   6.680   0.000   0.000   0.000
  0.000   0.000  -0.000   0.000 -23.418   0.000  -0.000   0.000   0.000   0.000  -0.000   0.000   0.000   0.000   6.684   0.000
  0.006   0.000   0.000   0.207  -0.000   0.000 -23.407   0.000  -0.000   0.000  -0.003   0.000  -0.000  -0.126   0.000   0.000
 -0.000   0.415   0.006   0.000   0.000   0.000  -0.000   0.000 -23.410   0.000   0.000  -0.252  -0.003   0.000  -0.000   0.000
  6.681   0.000   0.000   0.000  -0.000   0.000  -0.003   0.000   0.000   0.252   2.798   0.000  -0.000   0.000   0.000   0.000
  0.000   0.000   6.680   0.000   0.000   0.000  -0.000   0.126  -0.003   0.000  -0.000   0.000   2.798   0.000  -0.000   0.000
 -0.000   0.000   0.000   0.000   6.684   0.000   0.000   0.000  -0.000   0.000   0.000   0.000  -0.000   0.000   2.797   0.000
 -0.003   0.000  -0.000  -0.126   0.000   0.000   6.680   0.000   0.000   0.000   0.000   0.000  -0.000   0.077  -0.000   0.000
  0.000  -0.252  -0.003   0.000  -0.000   0.000   0.000   0.000   6.681   0.000   0.000   0.154   0.000   0.000   0.000   0.000
  0.000   0.000   0.000   0.000  -0.001   0.000   0.000   0.000   0.000   0.000  -0.000   0.000  -0.000   0.000  -0.001   0.000
 -0.000   0.000  -0.000   0.000   0.001   0.000  -0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.001   0.000
 -0.000   0.000   0.001   0.000  -0.000   0.000  -0.000   0.000   0.001   0.000  -0.000   0.000   0.001   0.000   0.000   0.000
 -0.000   0.000   0.000   0.000   0.001   0.000  -0.000   0.000  -0.000   0.000   0.000   0.000   0.000   0.000   0.002   0.000
  0.001   0.000  -0.000   0.000   0.000   0.000   0.001   0.000  -0.000   0.000  -0.000   0.000   0.000   0.000  -0.000   0.000
 -0.000   0.000   0.002   0.000  -0.000   0.000  -0.000   0.000   0.001   0.000  -0.000   0.000   0.002   0.000   0.000   0.000
 -0.000   0.000   0.000   0.000   0.001   0.000  -0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.003   0.000
  0.001   0.000  -0.000   0.000   0.000   0.000   0.002   0.000  -0.000   0.000  -0.001   0.000   0.000   0.000  -0.000   0.000
 total augmentation occupancy for first ion, spin component:           1
  2.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000
  0.000   2.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000
  0.000   0.000   2.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000
  0.000   0.000   0.000   2.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000
  0.000   0.000   0.000   0.000   2.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000
  0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000
  0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000
  0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000
  0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000
  0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000
  0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   2.000   0.000   0.000   0.000   0.000   0.000
  0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000
  0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.667   0.000   0.000   0.000
  0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.667   0.000   0.000
  0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.667   0.000
  0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000
  0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000
  0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000
 total augmentation occupancy for first ion, spin component:           2
  0.143   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000
  0.000   0.143   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000
  0.000   0.000   0.143   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000
  0.000   0.000   0.000   0.143   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000
  0.000   0.000   0.000   0.000   0.143   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000
  0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000
  0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000
  0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000
  0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000
  0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000
  0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.143   0.000   0.000   0.000   0.000   0.000
  0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000
  0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.048   0.000   0.000   0.000
  0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.048   0.000   0.000
  0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.048   0.000
  0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000
  0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000
  0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000
 total augmentation occupancy for first ion, spin component:           3
  0.143   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000
  0.000   0.143   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000
  0.000   0.000   0.143   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000
  0.000   0.000   0.000   0.143   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000
  0.000   0.000   0.000   0.000   0.143   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000
  0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000
  0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000
  0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000
  0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000
  0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000
  0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.143   0.000   0.000   0.000   0.000   0.000
  0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000
  0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.048   0.000   0.000   0.000
  0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.048   0.000   0.000
  0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.048   0.000
  0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000
  0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000
  0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000
 total augmentation occupancy for first ion, spin component:           4
  0.143   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000
  0.000   0.143   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000
  0.000   0.000   0.143   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000
  0.000   0.000   0.000   0.143   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000
  0.000   0.000   0.000   0.000   0.143   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000
  0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000
  0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000
  0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000
  0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000
  0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000
  0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.143   0.000   0.000   0.000   0.000   0.000
  0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000
  0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.048   0.000   0.000   0.000
  0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.048   0.000   0.000
  0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.048   0.000
  0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000
  0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000
  0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000   0.000


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


 


 total charge     
 
# of ion       s       p       d       tot
------------------------------------------
    1        1.184   0.839  10.048  12.070
    2        1.478   2.303   0.024   3.805
    3        1.454   2.388   0.019   3.861
    4        1.255   2.307   0.000   3.562
    5        2.023   5.801   0.235   8.059
    6        2.041   5.773   0.299   8.113
--------------------------------------------------
tot          9.435  19.410  10.624  39.469
 


 magnetization (x)
 
# of ion       s       p       d       tot
------------------------------------------
    1       -0.000  -0.002  -0.000  -0.002
    2        0.000  -0.005  -0.000  -0.005
    3       -0.000   0.002  -0.000   0.001
    4       -0.000   0.001   0.000   0.001
    5        0.000   0.000   0.000   0.000
    6       -0.000  -0.001   0.000  -0.001
--------------------------------------------------
tot         -0.000  -0.005  -0.000  -0.005
 


 magnetization (y)
 
# of ion       s       p       d       tot
------------------------------------------
    1       -0.002   0.001   0.000  -0.001
    2       -0.000   0.003   0.000   0.003
    3        0.000  -0.003  -0.000  -0.003
    4        0.000   0.000   0.000   0.000
    5       -0.000  -0.000   0.000  -0.000
    6        0.000   0.001   0.000   0.001
--------------------------------------------------
tot         -0.002   0.001   0.000  -0.000
 


 magnetization (z)
 
# of ion       s       p       d       tot
------------------------------------------
    1        0.000  -0.002  -0.000  -0.002
    2        0.000  -0.003  -0.000  -0.003
    3       -0.000   0.002  -0.000   0.002
    4        0.000   0.000   0.000   0.001
    5       -0.000  -0.000   0.000   0.000
    6       -0.000   0.001  -0.000   0.001
--------------------------------------------------
tot         -0.000  -0.001  -0.000  -0.001
 
    CHARGE:  cpu time    6.8211: real time    6.8263
    FORLOC:  cpu time    0.0386: real time    0.0387
    FORNL :  cpu time   10.5823: real time   10.5887
    STRESS:  cpu time   30.6308: real time   30.6521
    FORCOR:  cpu time    0.8920: real time    0.8934
    FORHAR:  cpu time    0.0913: real time    0.0914
    OFIELD:  cpu time    0.0052: real time    0.0052

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

         DFTD3 V3.0 Rev 1        
 IVDW         = 11
 DF pbe       
 parameters
 VDW_S6       =    1.0000
 VDW_S8       =    0.7220
 VDW_SR       =    1.2170
 rs18     =    1.0000
 alpha6   =   14.0000
 alpha8   =   16.0000
 k1-k3    =   16.0000    1.3333   -4.0000
 VDW_RADIUS   =   50.2022 A
 VDW_CNRADIUS =   21.1671 A
 Edisp (eV)   -0.93687

 E6    (eV) :    -0.3575
 E8    (eV) :    -0.5794
 % E8        : 61.85
    FORVDW:  cpu time    0.0172: real time    0.0172

  FORCE on cell =-STRESS in cart. coord.  units (eV):
  Direction    XX          YY          ZZ          XY          YZ          ZX
  --------------------------------------------------------------------------------------
  Alpha Z    56.77423    56.77423    56.77423
  Ewald   30723.18034 30723.18034-32942.89936    -0.00000     0.00000    -0.00000
  Hartree 31638.57456 31638.67178-31006.25221    -0.18397     0.15603     0.73831
  E(xc)    -211.75991  -211.84824  -212.00615     0.18720     0.01147    -0.04370
  Local  -63029.03600-63032.15399 63285.11539     6.54537     0.28327    -1.54652
  n-local    33.89274    32.37107    33.35703     1.69652     0.48947     2.00911
  augment   179.29070   179.34684   179.48591     0.09765    -0.04838    -0.28779
  Kinetic   606.55761   616.68498   603.53450   -13.23308    -1.93492    -3.96167
  Fock        0.00000     0.00000     0.00000     0.00000     0.00000     0.00000
  vdW        -1.03143    -1.03143    -0.73520     0.00000     0.00000    -0.00000
  -------------------------------------------------------------------------------------
  Total      -3.55717     1.99558    -3.62586    -4.89031    -1.04306    -3.09225
  in kB     -10.70397     6.00496   -10.91066   -14.71553    -3.13870    -9.30496
  external pressure =       -5.20 kB  Pullay stress =        0.00 kB


 VOLUME and BASIS-vectors are now :
 -----------------------------------------------------------------------------
  energy-cutoff  :      520.00
  volume of cell :      532.44
      direct lattice vectors                 reciprocal lattice vectors
     3.950115621  0.000000000  0.000000000     0.253157147  0.146160347 -0.000000000
    -1.975057810  3.420900474  0.000000000    -0.000000000  0.292320694 -0.000000000
    -0.000000000  0.000000000 39.402187794     0.000000000  0.000000000  0.025379301

  length of vectors
     3.950115621  3.950115619 39.402187794     0.292320694  0.292320694  0.025379301


 FORCES acting on ions
    electron-ion (+dipol)            ewald-force                    non-local-force                 convergence-correction
 -----------------------------------------------------------------------------------------------
   -.111E+01 -.121E+00 -.174E+04   0.563E-07 -.118E-07 0.173E+04   0.521E+00 0.113E+00 0.943E+00   0.672E+00 0.663E-01 0.396E+01
   -.120E-01 0.225E-01 -.128E+04   -.172E-06 0.338E-07 0.129E+04   -.298E+00 -.194E+00 -.279E+01   0.165E+00 0.651E-01 -.682E+00
   -.300E+00 -.333E+00 -.152E+03   0.164E-06 -.300E-07 0.145E+03   0.294E+00 0.320E+00 0.112E+01   -.441E-01 0.217E-01 0.543E+01
   -.488E+00 -.186E+00 0.658E+03   -.320E-06 0.208E-06 -.663E+03   -.911E+00 -.290E+00 0.816E-01   0.600E+00 0.213E+00 0.506E+01
   0.241E+00 0.193E-01 0.541E+03   0.173E-07 -.757E-08 -.554E+03   -.424E+00 -.121E+00 0.232E+01   -.203E+00 -.234E-01 0.112E+02
   0.169E+00 -.250E-02 0.195E+04   0.255E-06 -.192E-06 -.195E+04   0.109E+01 0.372E+00 -.621E+01   -.503E-01 0.232E-01 0.874E+01
 -----------------------------------------------------------------------------------------------
   -.150E+01 -.602E+00 -.293E+02   -.161E-13 0.865E-14 0.455E-12   0.272E+00 0.200E+00 -.453E+01   0.114E+01 0.366E+00 0.337E+02
 
 
 POSITION                                       TOTAL-FORCE (eV/Angst)
 -----------------------------------------------------------------------------------
     -0.00000      0.00000     23.40573         0.097001      0.063822      0.002277
      1.97506      1.14030     24.92478        -0.130914     -0.100659      0.033141
     -0.00000      2.28060     21.59988        -0.034719      0.014911      0.041882
      1.97506      1.14030     17.88755        -0.784128     -0.258050      0.075431
     -0.00000      0.00000     19.44204        -0.370981     -0.118773     -0.153923
     -0.00000      2.28060     16.73830         1.223741      0.398749      0.001192
 -----------------------------------------------------------------------------------
    total drift:                               -0.089539     -0.036375     -0.181847


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



  FREE ENERGIE OF THE ION-ELECTRON SYSTEM (eV)
  ---------------------------------------------------
  free  energy   TOTEN  =       -26.82877158 eV

  energy  without entropy=      -26.82698459  energy(sigma->0) =      -26.82787809
 


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


    POTLOK:  cpu time    1.4201: real time    1.4226


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


     LOOP+:  cpu time 1017.9113: real time 1019.4147
    4ORBIT:  cpu time    0.0000: real time    0.0000
 


 orbital moment (x)
 
 # of ion     p       d       tot
 ----------------------------------------
  1         0.016   0.009   0.025
  2        -0.111  -0.008  -0.119
  3         0.070   0.003   0.073
  4        -0.021   0.000  -0.021
  5        -0.003  -0.026  -0.029
  6         0.001   0.059   0.060
 ----------------------------------------
           -0.049   0.038  -0.010
 


 orbital moment (y)
 
 # of ion     p       d       tot
 ----------------------------------------
  1        -0.005  -0.008  -0.013
  2         0.088   0.005   0.092
  3        -0.052  -0.001  -0.053
  4         0.023   0.000   0.023
  5         0.001   0.017   0.018
  6        -0.001  -0.046  -0.047
 ----------------------------------------
            0.053  -0.033   0.020
 


 orbital moment (z)
 
 # of ion     p       d       tot
 ----------------------------------------
  1         0.012   0.015   0.026
  2        -0.119  -0.005  -0.124
  3         0.099   0.003   0.102
  4         0.007   0.000   0.007
  5         0.003   0.034   0.037
  6         0.002  -0.096  -0.094
 ----------------------------------------
            0.003  -0.049  -0.047

 Spin-Orbit-Coupling matrix elements

 Ion:    1  E_soc:     -0.0848170
 l=   1
     0.0000000    -0.0079216    -0.0080485
    -0.0079216     0.0000000    -0.0081836
    -0.0080485    -0.0081836     0.0000000
 l=   2
     0.0000000    -0.0012198     0.0000000    -0.0012188    -0.0049003
    -0.0012198     0.0000000    -0.0036412    -0.0012126    -0.0012213
     0.0000000    -0.0036412     0.0000000    -0.0036299     0.0000000
    -0.0012188    -0.0012126    -0.0036299     0.0000000    -0.0012109
    -0.0049003    -0.0012213     0.0000000    -0.0012109     0.0000000
 l=   3
     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000
     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000
     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000
     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000
     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000
     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000
     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000

 Ion:    2  E_soc:     -0.0455937
 l=   1
     0.0000000    -0.0076739    -0.0071736
    -0.0076739     0.0000000    -0.0079563
    -0.0071736    -0.0079563     0.0000000
 l=   2
     0.0000000     0.0000003     0.0000000     0.0000003    -0.0000008
     0.0000003     0.0000000     0.0000023     0.0000029     0.0000001
     0.0000000     0.0000023     0.0000000     0.0000017     0.0000000
     0.0000003     0.0000029     0.0000017     0.0000000    -0.0000000
    -0.0000008     0.0000001     0.0000000    -0.0000000     0.0000000
 l=   3
     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000
     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000
     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000
     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000
     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000
     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000
     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000

 Ion:    3  E_soc:     -0.0412864
 l=   1
     0.0000000    -0.0069288    -0.0067125
    -0.0069288     0.0000000    -0.0070035
    -0.0067125    -0.0070035     0.0000000
 l=   2
     0.0000000     0.0000009     0.0000000     0.0000007    -0.0000018
     0.0000009     0.0000000    -0.0000002     0.0000015    -0.0000003
     0.0000000    -0.0000002     0.0000000     0.0000002     0.0000000
     0.0000007     0.0000015     0.0000002     0.0000000     0.0000008
    -0.0000018    -0.0000003     0.0000000     0.0000008     0.0000000
 l=   3
     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000
     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000
     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000
     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000
     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000
     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000
     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000

 Ion:    4  E_soc:     -0.0001623
 l=   1
     0.0000000    -0.0000254    -0.0000284
    -0.0000254     0.0000000    -0.0000273
    -0.0000284    -0.0000273     0.0000000
 l=   2
     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000
     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000
     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000
     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000
     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000
 l=   3
     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000
     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000
     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000
     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000
     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000
     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000
     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000

 Ion:    5  E_soc:     -0.1761348
 l=   1
     0.0000000    -0.0292833    -0.0292984
    -0.0292833     0.0000000    -0.0293740
    -0.0292984    -0.0293740     0.0000000
 l=   2
     0.0000000    -0.0000121     0.0000000    -0.0000111    -0.0000226
    -0.0000121     0.0000000    -0.0000200    -0.0000115    -0.0000079
     0.0000000    -0.0000200     0.0000000    -0.0000174     0.0000000
    -0.0000111    -0.0000115    -0.0000174     0.0000000    -0.0000092
    -0.0000226    -0.0000079     0.0000000    -0.0000092     0.0000000
 l=   3
     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000
     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000
     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000
     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000
     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000
     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000
     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000

 Ion:    6  E_soc:     -0.1768232
 l=   1
     0.0000000    -0.0293634    -0.0294841
    -0.0293634     0.0000000    -0.0294698
    -0.0294841    -0.0294698     0.0000000
 l=   2
     0.0000000    -0.0000091     0.0000000    -0.0000081    -0.0000414
    -0.0000091     0.0000000    -0.0000128     0.0000034    -0.0000094
     0.0000000    -0.0000128     0.0000000    -0.0000111     0.0000000
    -0.0000081     0.0000034    -0.0000111     0.0000000    -0.0000058
    -0.0000414    -0.0000094     0.0000000    -0.0000058     0.0000000
 l=   3
     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000
     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000
     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000
     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000
     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000
     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000
     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000     0.0000000
 


 total charge     
 
# of ion       s       p       d       tot
------------------------------------------
    1        1.184   0.839  10.048  12.070
    2        1.478   2.303   0.024   3.805
    3        1.454   2.388   0.019   3.861
    4        1.255   2.307   0.000   3.562
    5        2.023   5.801   0.235   8.059
    6        2.041   5.773   0.299   8.113
--------------------------------------------------
tot          9.435  19.410  10.624  39.469
 


 magnetization (x)
 
# of ion       s       p       d       tot
------------------------------------------
    1       -0.000  -0.002  -0.000  -0.002
    2        0.000  -0.005  -0.000  -0.005
    3       -0.000   0.002  -0.000   0.001
    4       -0.000   0.001   0.000   0.001
    5        0.000   0.000   0.000   0.000
    6       -0.000  -0.001   0.000  -0.001
--------------------------------------------------
tot         -0.000  -0.005  -0.000  -0.005
 


 magnetization (y)
 
# of ion       s       p       d       tot
------------------------------------------
    1       -0.002   0.001   0.000  -0.001
    2       -0.000   0.003   0.000   0.003
    3        0.000  -0.003  -0.000  -0.003
    4        0.000   0.000   0.000   0.000
    5       -0.000  -0.000   0.000  -0.000
    6        0.000   0.001   0.000   0.001
--------------------------------------------------
tot         -0.002   0.001   0.000  -0.000
 


 magnetization (z)
 
# of ion       s       p       d       tot
------------------------------------------
    1        0.000  -0.002  -0.000  -0.002
    2        0.000  -0.003  -0.000  -0.003
    3       -0.000   0.002  -0.000   0.002
    4        0.000   0.000   0.000   0.001
    5       -0.000  -0.000   0.000   0.000
    6       -0.000   0.001  -0.000   0.001
--------------------------------------------------
tot         -0.000  -0.001  -0.000  -0.001
 

 total amount of memory used by VASP MPI-rank0  2042483. kBytes
=======================================================================

   base      :      30000. kBytes
   nonl-proj :    1251770. kBytes
   fftplans  :      20710. kBytes
   grid      :     110638. kBytes
   one-center:        373. kBytes
   wavefun   :     628992. kBytes
 
  
  
 General timing and accounting informations for this job:
 ========================================================
  
                  Total CPU time used (sec):     1075.321
                            User time (sec):     1052.651
                          System time (sec):       22.670
                         Elapsed time (sec):     1077.390
  
                   Maximum memory used (kb):     2095320.
                   Average memory used (kb):           0.
  
                          Minor page faults:      2645632
                          Major page faults:            0
                 Voluntary context switches:          915
