! Pwscf input file created with ciftopw.py 
! Compound: ZnSiO3
&control
         calculation     = 'bands'
         prefix          = 'ZnSiO3'
         restart_mode    = 'from_scratch'
         outdir          = './'
         wf_collect      = .true.
         verbosity       = 'high'
       /
&system
         ibrav           =  14
         celldm(1)       =           12.1942586538690332
         celldm(2)       =            1.0000000000000000
         celldm(3)       =            0.7717431368600748
         celldm(4)       =            0.1752270963898488
         celldm(5)       =            0.1752270963898488
         celldm(6)       =            0.0632065817906679
         nat             =       20
         ntyp            =        3
         ecutwfc         =       47.00000000
         ecutrho         =      324.00000000
         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
 O  15.9994 O.rel-pbe-n-rrkjus_psl.1.0.0.UPF 
Zn  65.4090 Zn.rel-pbe-dn-rrkjus_psl.1.0.0.UPF 
Si  28.0855 Si.rel-pbe-n-rrkjus_psl.1.0.0.UPF 
ATOMIC_POSITIONS crystal
K_POINTS crystal
245
      0.00000000       0.00000000       0.00000000 1.0 
      0.01428571       0.01428571       0.00000000 1.0 
      0.02857143       0.02857143       0.00000000 1.0 
      0.04285714       0.04285714       0.00000000 1.0 
      0.05714286       0.05714286       0.00000000 1.0 
      0.07142857       0.07142857       0.00000000 1.0 
      0.08571429       0.08571429       0.00000000 1.0 
      0.10000000       0.10000000       0.00000000 1.0 
      0.11428571       0.11428571       0.00000000 1.0 
      0.12857143       0.12857143       0.00000000 1.0 
      0.14285714       0.14285714       0.00000000 1.0 
      0.15714286       0.15714286       0.00000000 1.0 
      0.17142857       0.17142857       0.00000000 1.0 
      0.18571429       0.18571429       0.00000000 1.0 
      0.20000000       0.20000000       0.00000000 1.0 
      0.21428571       0.21428571       0.00000000 1.0 
      0.22857143       0.22857143       0.00000000 1.0 
      0.24285714       0.24285714       0.00000000 1.0 
      0.25714286       0.25714286       0.00000000 1.0 
      0.27142857       0.27142857       0.00000000 1.0 
      0.28571429       0.28571429       0.00000000 1.0 
      0.30000000       0.30000000       0.00000000 1.0 
      0.31428571       0.31428571       0.00000000 1.0 
      0.32857143       0.32857143       0.00000000 1.0 
      0.34285714       0.34285714       0.00000000 1.0 
      0.35714286       0.35714286       0.00000000 1.0 
      0.37142857       0.37142857       0.00000000 1.0 
      0.38571429       0.38571429       0.00000000 1.0 
      0.40000000       0.40000000       0.00000000 1.0 
      0.41428571       0.41428571       0.00000000 1.0 
      0.42857143       0.42857143       0.00000000 1.0 
      0.44285714       0.44285714      -0.00000000 1.0 
      0.45714286       0.45714286       0.00000000 1.0 
      0.47142857       0.47142857       0.00000000 1.0 
      0.48571429       0.48571429       0.00000000 1.0 
      0.50000000       0.50000000       0.00000000 1.0 
      0.50000000       0.50000000       0.00000000 1.0 
      0.50359346       0.50359346       0.01582647 1.0 
      0.50718692       0.50718692       0.03165294 1.0 
      0.51078037       0.51078037       0.04747941 1.0 
      0.51437383       0.51437383       0.06330588 1.0 
      0.51796729       0.51796729       0.07913236 1.0 
      0.52156075       0.52156075       0.09495883 1.0 
      0.52515421       0.52515421       0.11078530 1.0 
      0.52874766       0.52874766       0.12661177 1.0 
      0.53234112       0.53234112       0.14243824 1.0 
      0.53593458       0.53593458       0.15826471 1.0 
      0.53952804       0.53952804       0.17409118 1.0 
      0.54312150       0.54312150       0.18991765 1.0 
      0.54671495       0.54671495       0.20574412 1.0 
      0.55030841       0.55030841       0.22157059 1.0 
      0.55390187       0.55390187       0.23739707 1.0 
      0.55749533       0.55749533       0.25322354 1.0 
      0.56108879       0.56108879       0.26905001 1.0 
      0.56468224       0.56468224       0.28487648 1.0 
      0.56827570       0.56827570       0.30070295 1.0 
      0.57186916       0.57186916       0.31652942 1.0 
      0.57546262       0.57546262       0.33235589 1.0 
      0.57905608       0.57905608       0.34818236 1.0 
      0.58264953       0.58264953       0.36400883 1.0 
      0.58624299       0.58624299       0.37983530 1.0 
      0.58983645       0.58983645       0.39566178 1.0 
      0.58983645       0.58983645       0.39566178 1.0 
      0.58166950       0.58166950       0.40514707 1.0 
      0.57350255       0.57350255       0.41463236 1.0 
      0.56533560       0.56533560       0.42411765 1.0 
      0.55716865       0.55716865       0.43360295 1.0 
      0.54900170       0.54900170       0.44308824 1.0 
      0.54083475       0.54083475       0.45257353 1.0 
      0.53266780       0.53266780       0.46205883 1.0 
      0.52450085       0.52450085       0.47154412 1.0 
      0.51633390       0.51633390       0.48102941 1.0 
      0.50816695       0.50816695       0.49051471 1.0 
      0.50000000       0.50000000       0.50000000 1.0 
      0.50000000       0.50000000       0.50000000 1.0 
      0.51359802       0.48640198       0.50000000 1.0 
      0.52719605       0.47280395       0.50000000 1.0 
      0.54079407       0.45920593       0.50000000 1.0 
      0.55439210       0.44560790       0.50000000 1.0 
      0.56799012       0.43200988       0.50000000 1.0 
      0.58158815       0.41841185       0.50000000 1.0 
      0.59518617       0.40481383       0.50000000 1.0 
      0.60878420       0.39121580       0.50000000 1.0 
      0.62238222       0.37761778       0.50000000 1.0 
      0.37761778      -0.37761778       0.50000000 1.0 
      0.36363193      -0.36363193       0.50000000 1.0 
      0.34964609      -0.34964609       0.50000000 1.0 
      0.33566025      -0.33566025       0.50000000 1.0 
      0.32167440      -0.32167440       0.50000000 1.0 
      0.30768856      -0.30768856       0.50000000 1.0 
      0.29370272      -0.29370272       0.50000000 1.0 
      0.27971687      -0.27971687       0.50000000 1.0 
      0.26573103      -0.26573103       0.50000000 1.0 
      0.25174519      -0.25174519       0.50000000 1.0 
      0.23775934      -0.23775934       0.50000000 1.0 
      0.22377350      -0.22377350       0.50000000 1.0 
      0.20978765      -0.20978765       0.50000000 1.0 
      0.19580181      -0.19580181       0.50000000 1.0 
      0.18181597      -0.18181597       0.50000000 1.0 
      0.16783012      -0.16783012       0.50000000 1.0 
      0.15384428      -0.15384428       0.50000000 1.0 
      0.13985844      -0.13985844       0.50000000 1.0 
      0.12587259      -0.12587259       0.50000000 1.0 
      0.11188675      -0.11188675       0.50000000 1.0 
      0.09790091      -0.09790091       0.50000000 1.0 
      0.08391506      -0.08391506       0.50000000 1.0 
      0.06992922      -0.06992922       0.50000000 1.0 
      0.05594337      -0.05594337       0.50000000 1.0 
      0.04195753      -0.04195753       0.50000000 1.0 
      0.02797169      -0.02797169       0.50000000 1.0 
      0.01398584      -0.01398584       0.50000000 1.0 
      0.00000000       0.00000000       0.50000000 1.0 
      0.00000000       0.00000000       0.50000000 1.0 
      0.01464870       0.01464870       0.50372637 1.0 
      0.02929740       0.02929740       0.50745273 1.0 
      0.04394609       0.04394609       0.51117910 1.0 
      0.05859479       0.05859479       0.51490546 1.0 
      0.07324349       0.07324349       0.51863183 1.0 
      0.08789219       0.08789219       0.52235819 1.0 
      0.10254089       0.10254089       0.52608456 1.0 
      0.11718959       0.11718959       0.52981092 1.0 
      0.13183828       0.13183828       0.53353729 1.0 
      0.14648698       0.14648698       0.53726365 1.0 
      0.16113568       0.16113568       0.54099002 1.0 
      0.17578438       0.17578438       0.54471638 1.0 
      0.19043308       0.19043308       0.54844275 1.0 
      0.20508177       0.20508177       0.55216911 1.0 
      0.21973047       0.21973047       0.55589548 1.0 
      0.23437917       0.23437917       0.55962184 1.0 
      0.24902787       0.24902787       0.56334821 1.0 
      0.26367657       0.26367657       0.56707457 1.0 
      0.27832527       0.27832527       0.57080094 1.0 
      0.29297396       0.29297396       0.57452730 1.0 
      0.30762266       0.30762266       0.57825367 1.0 
      0.32227136       0.32227136       0.58198003 1.0 
      0.33692006       0.33692006       0.58570640 1.0 
      0.35156876       0.35156876       0.58943276 1.0 
      0.36621745       0.36621745       0.59315913 1.0 
      0.38086615       0.38086615       0.59688549 1.0 
      0.39551485       0.39551485       0.60061186 1.0 
      0.41016355       0.41016355       0.60433822 1.0 
      0.50000000       0.50000000       0.00000000 1.0 
      0.50811093       0.49188907       0.00000000 1.0 
      0.51622186       0.48377814       0.00000000 1.0 
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      0.45613367      -0.45613367       0.00000000 1.0 
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      0.15204456      -0.15204456       0.00000000 1.0 
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      0.48684211      -0.00000000       0.48684211 1.0 
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      0.02631579      -0.00000000       0.02631579 1.0 
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      0.00000000       0.00000000       0.00000000 1.0 

