! Pwscf input file created with ciftopw.py 
! Compound: RbNiC2BrN2
&control
         calculation     = 'bands'
         prefix          = 'RbNiC2BrN2'
         restart_mode    = 'from_scratch'
         outdir          = './'
         wf_collect      = .true.
         verbosity       = 'high'
       /
&system
         ibrav           =  14
         celldm(1)       =           14.4438116269191941
         celldm(2)       =            1.0000000000000000
         celldm(3)       =            1.0000000000000000
         celldm(4)       =           -0.5663181352576572
         celldm(5)       =           -0.5663181352576572
         celldm(6)       =            0.1326362705153148
         nat             =       14
         ntyp            =        5
         ecutwfc         =       50.00000000
         ecutrho         =      327.00000000
         occupations     =  'smearing'  
         smearing        =  'f-d' 
         degauss         =        1.00000000e-03  
         noncolin        =  .true. 
         lspinorb        =  .true. 
/
&electrons
         conv_thr        =        1.00000000e-05 
         mixing_beta     =        3.00000000e-01    
   /
ATOMIC_SPECIES
Br  79.9040 Br.rel-pbe-n-rrkjus_psl.1.0.0.UPF 
Ni  58.6934 Ni.rel-pbe-n-rrkjus_psl.1.0.0.UPF 
Rb  85.4678 Rb.rel-pbe-spn-rrkjus_psl.1.0.0.UPF 
 C  12.0107 C.rel-pbe-n-rrkjus_psl.1.0.0.UPF 
 N  14.0067 N.rel-pbe-n-rrkjus_psl.1.0.0.UPF 
ATOMIC_POSITIONS crystal
K_POINTS crystal
235
      0.00000000       0.00000000       0.00000000 1.0 
      0.00000000      -0.00000000       0.01562500 1.0 
      0.00000000      -0.00000000       0.03125000 1.0 
      0.00000000      -0.00000000       0.04687500 1.0 
      0.00000000      -0.00000000       0.06250000 1.0 
      0.00000000      -0.00000000       0.07812500 1.0 
      0.00000000      -0.00000000       0.09375000 1.0 
      0.00000000      -0.00000000       0.10937500 1.0 
      0.00000000      -0.00000000       0.12500000 1.0 
      0.00000000      -0.00000000       0.14062500 1.0 
      0.00000000      -0.00000000       0.15625000 1.0 
      0.00000000      -0.00000000       0.17187500 1.0 
      0.00000000      -0.00000000       0.18750000 1.0 
      0.00000000      -0.00000000       0.20312500 1.0 
      0.00000000      -0.00000000       0.21875000 1.0 
      0.00000000      -0.00000000       0.23437500 1.0 
      0.00000000      -0.00000000       0.25000000 1.0 
      0.00000000      -0.00000000       0.26562500 1.0 
      0.00000000      -0.00000000       0.28125000 1.0 
      0.00000000      -0.00000000       0.29687500 1.0 
      0.00000000      -0.00000000       0.31250000 1.0 
      0.00000000      -0.00000000       0.32812500 1.0 
      0.00000000      -0.00000000       0.34375000 1.0 
      0.00000000      -0.00000000       0.35937500 1.0 
      0.00000000      -0.00000000       0.37500000 1.0 
      0.00000000      -0.00000000       0.39062500 1.0 
      0.00000000      -0.00000000       0.40625000 1.0 
      0.00000000      -0.00000000       0.42187500 1.0 
      0.00000000      -0.00000000       0.43750000 1.0 
      0.00000000      -0.00000000       0.45312500 1.0 
      0.00000000      -0.00000000       0.46875000 1.0 
      0.00000000      -0.00000000       0.48437500 1.0 
      0.00000000      -0.00000000       0.50000000 1.0 
      0.00000000      -0.00000000       0.50000000 1.0 
     -0.01595400       0.01595400       0.50000000 1.0 
     -0.03190800       0.03190800       0.50000000 1.0 
     -0.04786200       0.04786200       0.50000000 1.0 
     -0.06381600       0.06381600       0.50000000 1.0 
     -0.07976999       0.07976999       0.50000000 1.0 
     -0.09572399       0.09572399       0.50000000 1.0 
     -0.11167799       0.11167799       0.50000000 1.0 
     -0.12763199       0.12763199       0.50000000 1.0 
     -0.14358599       0.14358599       0.50000000 1.0 
     -0.15953999       0.15953999       0.50000000 1.0 
     -0.17549399       0.17549399       0.50000000 1.0 
     -0.19144799       0.19144799       0.50000000 1.0 
     -0.19144799       0.19144799       0.50000000 1.0 
     -0.20246770       0.20246770       0.48898029 1.0 
     -0.21348742       0.21348742       0.47796057 1.0 
     -0.22450713       0.22450713       0.46694086 1.0 
     -0.23552684       0.23552684       0.45592114 1.0 
     -0.24654656       0.24654656       0.44490143 1.0 
     -0.25756627       0.25756627       0.43388171 1.0 
     -0.26858599       0.26858599       0.42286200 1.0 
     -0.27960570       0.27960570       0.41184228 1.0 
     -0.29062542       0.29062542       0.40082257 1.0 
     -0.30164513       0.30164513       0.38980285 1.0 
     -0.31266485       0.31266485       0.37878314 1.0 
     -0.32368456       0.32368456       0.36776342 1.0 
     -0.33470428       0.33470428       0.35674371 1.0 
     -0.34572399       0.34572399       0.34572399 1.0 
     -0.34572399       0.34572399       0.34572399 1.0 
     -0.33457161       0.33457161       0.33457161 1.0 
     -0.32341922       0.32341922       0.32341922 1.0 
     -0.31226683       0.31226683       0.31226683 1.0 
     -0.30111445       0.30111445       0.30111445 1.0 
     -0.28996206       0.28996206       0.28996206 1.0 
     -0.27880967       0.27880967       0.27880967 1.0 
     -0.26765728       0.26765728       0.26765728 1.0 
     -0.25650490       0.25650490       0.25650490 1.0 
     -0.24535251       0.24535251       0.24535251 1.0 
     -0.23420012       0.23420012       0.23420012 1.0 
     -0.22304774       0.22304774       0.22304774 1.0 
     -0.21189535       0.21189535       0.21189535 1.0 
     -0.20074296       0.20074296       0.20074296 1.0 
     -0.18959058       0.18959058       0.18959058 1.0 
     -0.17843819       0.17843819       0.17843819 1.0 
     -0.16728580       0.16728580       0.16728580 1.0 
     -0.15613342       0.15613342       0.15613342 1.0 
     -0.14498103       0.14498103       0.14498103 1.0 
     -0.13382864       0.13382864       0.13382864 1.0 
     -0.12267626       0.12267626       0.12267626 1.0 
     -0.11152387       0.11152387       0.11152387 1.0 
     -0.10037148       0.10037148       0.10037148 1.0 
     -0.08921909       0.08921909       0.08921909 1.0 
     -0.07806671       0.07806671       0.07806671 1.0 
     -0.06691432       0.06691432       0.06691432 1.0 
     -0.05576193       0.05576193       0.05576193 1.0 
     -0.04460955       0.04460955       0.04460955 1.0 
     -0.03345716       0.03345716       0.03345716 1.0 
     -0.02230477       0.02230477       0.02230477 1.0 
     -0.01115239       0.01115239       0.01115239 1.0 
      0.00000000       0.00000000       0.00000000 1.0 
      0.00000000       0.00000000       0.00000000 1.0 
      0.01785714       0.01785714      -0.01785714 1.0 
      0.03571429       0.03571429      -0.03571429 1.0 
      0.05357143       0.05357143      -0.05357143 1.0 
      0.07142857       0.07142857      -0.07142857 1.0 
      0.08928571       0.08928571      -0.08928571 1.0 
      0.10714286       0.10714286      -0.10714286 1.0 
      0.12500000       0.12500000      -0.12500000 1.0 
      0.14285714       0.14285714      -0.14285714 1.0 
      0.16071429       0.16071429      -0.16071429 1.0 
      0.17857143       0.17857143      -0.17857143 1.0 
      0.19642857       0.19642857      -0.19642857 1.0 
      0.21428571       0.21428571      -0.21428571 1.0 
      0.23214286       0.23214286      -0.23214286 1.0 
      0.25000000       0.25000000      -0.25000000 1.0 
      0.26785714       0.26785714      -0.26785714 1.0 
      0.28571429       0.28571429      -0.28571429 1.0 
      0.30357143       0.30357143      -0.30357143 1.0 
      0.32142857       0.32142857      -0.32142857 1.0 
      0.33928571       0.33928571      -0.33928571 1.0 
      0.35714286       0.35714286      -0.35714286 1.0 
      0.37500000       0.37500000      -0.37500000 1.0 
      0.39285714       0.39285714      -0.39285714 1.0 
      0.41071429       0.41071429      -0.41071429 1.0 
      0.42857143       0.42857143      -0.42857143 1.0 
      0.44642857       0.44642857      -0.44642857 1.0 
      0.46428571       0.46428571      -0.46428571 1.0 
      0.48214286       0.48214286      -0.48214286 1.0 
      0.50000000       0.50000000      -0.50000000 1.0 
      0.50000000       0.50000000      -0.50000000 1.0 
      0.48898029       0.51101971      -0.48898029 1.0 
      0.47796057       0.52203943      -0.47796057 1.0 
      0.46694086       0.53305914      -0.46694086 1.0 
      0.45592114       0.54407886      -0.45592114 1.0 
      0.44490143       0.55509857      -0.44490143 1.0 
      0.43388171       0.56611829      -0.43388171 1.0 
      0.42286200       0.57713800      -0.42286200 1.0 
      0.41184228       0.58815772      -0.41184228 1.0 
      0.40082257       0.59917743      -0.40082257 1.0 
      0.38980285       0.61019715      -0.38980285 1.0 
      0.37878314       0.62121686      -0.37878314 1.0 
      0.36776342       0.63223658      -0.36776342 1.0 
      0.35674371       0.64325629      -0.35674371 1.0 
      0.34572399       0.65427601      -0.34572399 1.0 
      0.34572399       0.65427601      -0.34572399 1.0 
      0.32538729       0.64520095      -0.32538729 1.0 
      0.30505058       0.63612589      -0.30505058 1.0 
      0.28471388       0.62705083      -0.28471388 1.0 
      0.26437717       0.61797577      -0.26437717 1.0 
      0.24404047       0.60890071      -0.24404047 1.0 
      0.22370376       0.59982565      -0.22370376 1.0 
      0.20336705       0.59075059      -0.20336705 1.0 
      0.18303035       0.58167553      -0.18303035 1.0 
      0.16269364       0.57260047      -0.16269364 1.0 
      0.14235694       0.56352541      -0.14235694 1.0 
      0.12202023       0.55445036      -0.12202023 1.0 
      0.10168353       0.54537530      -0.10168353 1.0 
      0.08134682       0.53630024      -0.08134682 1.0 
      0.06101012       0.52722518      -0.06101012 1.0 
      0.04067341       0.51815012      -0.04067341 1.0 
      0.02033671       0.50907506      -0.02033671 1.0 
      0.00000000       0.50000000       0.00000000 1.0 
      0.00000000       0.50000000       0.00000000 1.0 
      0.01086957       0.48913043       0.01086957 1.0 
      0.02173913       0.47826087       0.02173913 1.0 
      0.03260870       0.46739130       0.03260870 1.0 
      0.04347826       0.45652174       0.04347826 1.0 
      0.05434783       0.44565217       0.05434783 1.0 
      0.06521739       0.43478261       0.06521739 1.0 
      0.07608696       0.42391304       0.07608696 1.0 
      0.08695652       0.41304348       0.08695652 1.0 
      0.09782609       0.40217391       0.09782609 1.0 
      0.10869565       0.39130435       0.10869565 1.0 
      0.11956522       0.38043478       0.11956522 1.0 
      0.13043478       0.36956522       0.13043478 1.0 
      0.14130435       0.35869565       0.14130435 1.0 
      0.15217391       0.34782609       0.15217391 1.0 
      0.16304348       0.33695652       0.16304348 1.0 
      0.17391304       0.32608696       0.17391304 1.0 
      0.18478261       0.31521739       0.18478261 1.0 
      0.19565217       0.30434783       0.19565217 1.0 
      0.20652174       0.29347826       0.20652174 1.0 
      0.21739130       0.28260870       0.21739130 1.0 
      0.22826087       0.27173913       0.22826087 1.0 
      0.23913043       0.26086957       0.23913043 1.0 
      0.25000000       0.25000000       0.25000000 1.0 
      0.25000000       0.25000000       0.25000000 1.0 
      0.26315789       0.26315789       0.22676590 1.0 
      0.27631579       0.27631579       0.20353179 1.0 
      0.28947368       0.28947368       0.18029769 1.0 
      0.30263158       0.30263158       0.15706358 1.0 
      0.31578947       0.31578947       0.13382948 1.0 
      0.32894737       0.32894737       0.11059537 1.0 
      0.34210526       0.34210526       0.08736127 1.0 
      0.35526316       0.35526316       0.06412716 1.0 
      0.36842105       0.36842105       0.04089306 1.0 
      0.38157895       0.38157895       0.01765895 1.0 
      0.39473684       0.39473684      -0.00557515 1.0 
      0.40789474       0.40789474      -0.02880925 1.0 
      0.42105263       0.42105263      -0.05204336 1.0 
      0.43421053       0.43421053      -0.07527746 1.0 
      0.44736842       0.44736842      -0.09851157 1.0 
      0.46052632       0.46052632      -0.12174567 1.0 
      0.47368421       0.47368421      -0.14497978 1.0 
      0.48684211       0.48684211      -0.16821388 1.0 
      0.50000000       0.50000000      -0.19144799 1.0 
      0.50000000       0.50000000      -0.19144799 1.0 
      0.50000000       0.50000000      -0.20687559 1.0 
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      0.50000000       0.50000000      -0.26858599 1.0 
      0.50000000       0.50000000      -0.28401359 1.0 
      0.50000000       0.50000000      -0.29944119 1.0 
      0.50000000       0.50000000      -0.31486879 1.0 
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      0.50000000       0.50000000      -0.34572399 1.0 
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      0.50000000       0.50000000      -0.46914480 1.0 
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      0.50000000       0.50000000      -0.50000000 1.0 
      0.00000000      -0.00000000       0.50000000 1.0 
      0.01785714       0.01785714       0.48214286 1.0 
      0.03571429       0.03571429       0.46428571 1.0 
      0.05357143       0.05357143       0.44642857 1.0 
      0.07142857       0.07142857       0.42857143 1.0 
      0.08928571       0.08928571       0.41071429 1.0 
      0.10714286       0.10714286       0.39285714 1.0 
      0.12500000       0.12500000       0.37500000 1.0 
      0.14285714       0.14285714       0.35714286 1.0 
      0.16071429       0.16071429       0.33928571 1.0 
      0.17857143       0.17857143       0.32142857 1.0 
      0.19642857       0.19642857       0.30357143 1.0 
      0.21428571       0.21428571       0.28571429 1.0 
      0.23214286       0.23214286       0.26785714 1.0 
      0.25000000       0.25000000       0.25000000 1.0 

