! Pwscf input file created with ciftopw.py 
! Compound: H4CN
&control
         calculation     = 'bands'
         prefix          = 'H4CN'
         restart_mode    = 'from_scratch'
         outdir          = './'
         wf_collect      = .true.
         verbosity       = 'high'
       /
&system
         ibrav           =  14
         celldm(1)       =            9.8492518546679992
         celldm(2)       =            0.9785111281657713
         celldm(3)       =            1.3933231005372217
         celldm(4)       =            0.3681245526846777
         celldm(5)       =            0.0000000000000001
         celldm(6)       =            0.0000000000000001
         nat             =       24
         ntyp            =        3
         ecutwfc         =       46.00000000
         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
 H   1.0079 H.rel-pbe-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
256
      0.00000000       0.00000000       0.00000000 1.0 
      0.00000000       0.00000000       0.02083333 1.0 
      0.00000000       0.00000000       0.04166667 1.0 
      0.00000000       0.00000000       0.06250000 1.0 
      0.00000000       0.00000000       0.08333333 1.0 
      0.00000000       0.00000000       0.10416667 1.0 
      0.00000000       0.00000000       0.12500000 1.0 
      0.00000000       0.00000000       0.14583333 1.0 
      0.00000000       0.00000000       0.16666667 1.0 
      0.00000000       0.00000000       0.18750000 1.0 
      0.00000000       0.00000000       0.20833333 1.0 
      0.00000000       0.00000000       0.22916667 1.0 
      0.00000000       0.00000000       0.25000000 1.0 
      0.00000000       0.00000000       0.27083333 1.0 
      0.00000000       0.00000000       0.29166667 1.0 
      0.00000000       0.00000000       0.31250000 1.0 
      0.00000000       0.00000000       0.33333333 1.0 
      0.00000000       0.00000000       0.35416667 1.0 
      0.00000000       0.00000000       0.37500000 1.0 
      0.00000000       0.00000000       0.39583333 1.0 
      0.00000000       0.00000000       0.41666667 1.0 
      0.00000000       0.00000000       0.43750000 1.0 
      0.00000000       0.00000000       0.45833333 1.0 
      0.00000000       0.00000000       0.47916667 1.0 
      0.00000000       0.00000000       0.50000000 1.0 
      0.00000000       0.00000000       0.50000000 1.0 
      0.00000000       0.01588340       0.50832577 1.0 
      0.00000000       0.03176680       0.51665154 1.0 
      0.00000000       0.04765020       0.52497731 1.0 
      0.00000000       0.06353360       0.53330307 1.0 
      0.00000000       0.07941700       0.54162884 1.0 
      0.00000000       0.09530040       0.54995461 1.0 
      0.00000000       0.11118380       0.55828038 1.0 
      0.00000000       0.12706720       0.56660615 1.0 
      0.00000000       0.14295060       0.57493192 1.0 
      0.00000000       0.15883400       0.58325769 1.0 
      0.00000000       0.17471740       0.59158345 1.0 
      0.00000000       0.19060081       0.59990922 1.0 
      0.00000000       0.20648421       0.60823499 1.0 
      0.00000000       0.22236761       0.61656076 1.0 
      0.00000000       0.23825101       0.62488653 1.0 
      0.00000000       0.25413441       0.63321230 1.0 
      0.00000000       0.27001781       0.64153807 1.0 
      0.00000000       0.28590121       0.64986384 1.0 
      0.00000000       0.30178461       0.65818960 1.0 
      0.00000000       0.31766801       0.66651537 1.0 
      0.00000000       0.33355141       0.67484114 1.0 
      0.00000000       0.34943481       0.68316691 1.0 
      0.00000000       0.36531821       0.69149268 1.0 
      0.00000000       0.38120161       0.69981845 1.0 
      0.00000000       0.39708501       0.70814422 1.0 
      0.00000000       0.41296841       0.71646998 1.0 
      0.00000000       0.42885181       0.72479575 1.0 
      0.00000000       0.42885181       0.72479575 1.0 
      0.00000000       0.43432475       0.70750377 1.0 
      0.00000000       0.43979769       0.69021179 1.0 
      0.00000000       0.44527062       0.67291981 1.0 
      0.00000000       0.45074356       0.65562783 1.0 
      0.00000000       0.45621650       0.63833585 1.0 
      0.00000000       0.46168944       0.62104387 1.0 
      0.00000000       0.46716237       0.60375189 1.0 
      0.00000000       0.47263531       0.58645990 1.0 
      0.00000000       0.47810825       0.56916792 1.0 
      0.00000000       0.48358119       0.55187594 1.0 
      0.00000000       0.48905412       0.53458396 1.0 
      0.00000000       0.49452706       0.51729198 1.0 
      0.00000000       0.50000000       0.50000000 1.0 
      0.00000000       0.50000000       0.50000000 1.0 
      0.01612903       0.50000000       0.50000000 1.0 
      0.03225806       0.50000000       0.50000000 1.0 
      0.04838710       0.50000000       0.50000000 1.0 
      0.06451613       0.50000000       0.50000000 1.0 
      0.08064516       0.50000000       0.50000000 1.0 
      0.09677419       0.50000000       0.50000000 1.0 
      0.11290323       0.50000000       0.50000000 1.0 
      0.12903226       0.50000000       0.50000000 1.0 
      0.14516129       0.50000000       0.50000000 1.0 
      0.16129032       0.50000000       0.50000000 1.0 
      0.17741935       0.50000000       0.50000000 1.0 
      0.19354839       0.50000000       0.50000000 1.0 
      0.20967742       0.50000000       0.50000000 1.0 
      0.22580645       0.50000000       0.50000000 1.0 
      0.24193548       0.50000000       0.50000000 1.0 
      0.25806452       0.50000000       0.50000000 1.0 
      0.27419355       0.50000000       0.50000000 1.0 
      0.29032258       0.50000000       0.50000000 1.0 
      0.30645161       0.50000000       0.50000000 1.0 
      0.32258065       0.50000000       0.50000000 1.0 
      0.33870968       0.50000000       0.50000000 1.0 
      0.35483871       0.50000000       0.50000000 1.0 
      0.37096774       0.50000000       0.50000000 1.0 
      0.38709677       0.50000000       0.50000000 1.0 
      0.40322581       0.50000000       0.50000000 1.0 
      0.41935484       0.50000000       0.50000000 1.0 
      0.43548387       0.50000000       0.50000000 1.0 
      0.45161290       0.50000000       0.50000000 1.0 
      0.46774194       0.50000000       0.50000000 1.0 
      0.48387097       0.50000000       0.50000000 1.0 
      0.50000000       0.50000000       0.50000000 1.0 
      0.50000000       0.50000000       0.50000000 1.0 
      0.50000000       0.50547294       0.48270802 1.0 
      0.50000000       0.51094588       0.46541604 1.0 
      0.50000000       0.51641881       0.44812406 1.0 
      0.50000000       0.52189175       0.43083208 1.0 
      0.50000000       0.52736469       0.41354010 1.0 
      0.50000000       0.53283763       0.39624811 1.0 
      0.50000000       0.53831056       0.37895613 1.0 
      0.50000000       0.54378350       0.36166415 1.0 
      0.50000000       0.54925644       0.34437217 1.0 
      0.50000000       0.55472938       0.32708019 1.0 
      0.50000000       0.56020231       0.30978821 1.0 
      0.50000000       0.56567525       0.29249623 1.0 
      0.50000000       0.57114819       0.27520425 1.0 
      0.50000000       0.57114819       0.27520425 1.0 
      0.50000000       0.56521917       0.25227056 1.0 
      0.50000000       0.55929016       0.22933687 1.0 
      0.50000000       0.55336114       0.20640319 1.0 
      0.50000000       0.54743213       0.18346950 1.0 
      0.50000000       0.54150311       0.16053581 1.0 
      0.50000000       0.53557409       0.13760212 1.0 
      0.50000000       0.52964508       0.11466844 1.0 
      0.50000000       0.52371606       0.09173475 1.0 
      0.50000000       0.51778705       0.06880106 1.0 
      0.50000000       0.51185803       0.04586737 1.0 
      0.50000000       0.50592902       0.02293369 1.0 
      0.50000000       0.50000000       0.00000000 1.0 
      0.50000000       0.50000000       0.00000000 1.0 
      0.48387097       0.50000000       0.00000000 1.0 
      0.46774194       0.50000000       0.00000000 1.0 
      0.45161290       0.50000000       0.00000000 1.0 
      0.43548387       0.50000000       0.00000000 1.0 
      0.41935484       0.50000000       0.00000000 1.0 
      0.40322581       0.50000000       0.00000000 1.0 
      0.38709677       0.50000000       0.00000000 1.0 
      0.37096774       0.50000000       0.00000000 1.0 
      0.35483871       0.50000000       0.00000000 1.0 
      0.33870968       0.50000000       0.00000000 1.0 
      0.32258065       0.50000000       0.00000000 1.0 
      0.30645161       0.50000000       0.00000000 1.0 
      0.29032258       0.50000000       0.00000000 1.0 
      0.27419355       0.50000000       0.00000000 1.0 
      0.25806452       0.50000000       0.00000000 1.0 
      0.24193548       0.50000000       0.00000000 1.0 
      0.22580645       0.50000000       0.00000000 1.0 
      0.20967742       0.50000000       0.00000000 1.0 
      0.19354839       0.50000000       0.00000000 1.0 
      0.17741935       0.50000000       0.00000000 1.0 
      0.16129032       0.50000000       0.00000000 1.0 
      0.14516129       0.50000000       0.00000000 1.0 
      0.12903226       0.50000000       0.00000000 1.0 
      0.11290323       0.50000000       0.00000000 1.0 
      0.09677419       0.50000000       0.00000000 1.0 
      0.08064516       0.50000000       0.00000000 1.0 
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      0.04838710       0.50000000       0.00000000 1.0 
      0.03225806       0.50000000       0.00000000 1.0 
      0.01612903       0.50000000       0.00000000 1.0 
      0.00000000       0.50000000       0.00000000 1.0 
      0.00000000       0.50000000       0.00000000 1.0 
      0.00000000       0.50592902       0.02293369 1.0 
      0.00000000       0.51185803       0.04586737 1.0 
      0.00000000       0.51778705       0.06880106 1.0 
      0.00000000       0.52371606       0.09173475 1.0 
      0.00000000       0.52964508       0.11466844 1.0 
      0.00000000       0.53557409       0.13760212 1.0 
      0.00000000       0.54150311       0.16053581 1.0 
      0.00000000       0.54743213       0.18346950 1.0 
      0.00000000       0.55336114       0.20640319 1.0 
      0.00000000       0.55929016       0.22933687 1.0 
      0.00000000       0.56521917       0.25227056 1.0 
      0.00000000       0.57114819       0.27520425 1.0 
      0.50000000       0.42885181       0.72479575 1.0 
      0.50000000       0.41296841       0.71646998 1.0 
      0.50000000       0.39708501       0.70814422 1.0 
      0.50000000       0.38120161       0.69981845 1.0 
      0.50000000       0.36531821       0.69149268 1.0 
      0.50000000       0.34943481       0.68316691 1.0 
      0.50000000       0.33355141       0.67484114 1.0 
      0.50000000       0.31766801       0.66651537 1.0 
      0.50000000       0.30178461       0.65818960 1.0 
      0.50000000       0.28590121       0.64986384 1.0 
      0.50000000       0.27001781       0.64153807 1.0 
      0.50000000       0.25413441       0.63321230 1.0 
      0.50000000       0.23825101       0.62488653 1.0 
      0.50000000       0.22236761       0.61656076 1.0 
      0.50000000       0.20648421       0.60823499 1.0 
      0.50000000       0.19060081       0.59990922 1.0 
      0.50000000       0.17471740       0.59158345 1.0 
      0.50000000       0.15883400       0.58325769 1.0 
      0.50000000       0.14295060       0.57493192 1.0 
      0.50000000       0.12706720       0.56660615 1.0 
      0.50000000       0.11118380       0.55828038 1.0 
      0.50000000       0.09530040       0.54995461 1.0 
      0.50000000       0.07941700       0.54162884 1.0 
      0.50000000       0.06353360       0.53330307 1.0 
      0.50000000       0.04765020       0.52497731 1.0 
      0.50000000       0.03176680       0.51665154 1.0 
      0.50000000       0.01588340       0.50832577 1.0 
      0.50000000       0.00000000       0.50000000 1.0 
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      0.50000000       0.00000000       0.43750000 1.0 
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      0.50000000       0.00000000       0.39583333 1.0 
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      0.50000000       0.00000000       0.35416667 1.0 
      0.50000000       0.00000000       0.33333333 1.0 
      0.50000000       0.00000000       0.31250000 1.0 
      0.50000000       0.00000000       0.29166667 1.0 
      0.50000000       0.00000000       0.27083333 1.0 
      0.50000000       0.00000000       0.25000000 1.0 
      0.50000000       0.00000000       0.22916667 1.0 
      0.50000000       0.00000000       0.20833333 1.0 
      0.50000000       0.00000000       0.18750000 1.0 
      0.50000000       0.00000000       0.16666667 1.0 
      0.50000000       0.00000000       0.14583333 1.0 
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      0.50000000       0.00000000       0.06250000 1.0 
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      0.50000000       0.00000000       0.02083333 1.0 
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      0.00000000       0.00000000       0.50000000 1.0 
      0.01612903       0.00000000       0.50000000 1.0 
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      0.04838710       0.00000000       0.50000000 1.0 
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      0.40322581       0.00000000       0.50000000 1.0 
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