! Pwscf input file created with ciftopw.py 
! Compound: BiAsO4
&control
         calculation     = 'bands'
         prefix          = 'BiAsO4'
         restart_mode    = 'from_scratch'
         outdir          = './'
         wf_collect      = .true.
         verbosity       = 'high'
       /
&system
         ibrav           =  14
         celldm(1)       =           12.9726213819259559
         celldm(2)       =            1.0000000000000000
         celldm(3)       =            1.0000000000000000
         celldm(4)       =           -0.7261961095538102
         celldm(5)       =           -0.7261961095538102
         celldm(6)       =            0.4523922191076207
         nat             =       12
         ntyp            =        3
         ecutwfc         =       47.00000000
         ecutrho         =      457.00000000
         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 
As  74.9216 As.rel-pbe-n-rrkjus_psl.1.0.0.UPF 
Bi 208.9804 Bi.rel-pbe-dn-rrkjus_psl.1.0.0.UPF 
ATOMIC_POSITIONS crystal
K_POINTS crystal
292
      0.00000000       0.00000000       0.00000000 1.0 
      0.00000000       0.00000000       0.01136364 1.0 
      0.00000000       0.00000000       0.02272727 1.0 
      0.00000000       0.00000000       0.03409091 1.0 
      0.00000000       0.00000000       0.04545455 1.0 
      0.00000000       0.00000000       0.05681818 1.0 
      0.00000000       0.00000000       0.06818182 1.0 
      0.00000000       0.00000000       0.07954545 1.0 
      0.00000000       0.00000000       0.09090909 1.0 
     -0.00000000       0.00000000       0.10227273 1.0 
      0.00000000       0.00000000       0.11363636 1.0 
     -0.00000000       0.00000000       0.12500000 1.0 
      0.00000000       0.00000000       0.13636364 1.0 
      0.00000000       0.00000000       0.14772727 1.0 
      0.00000000       0.00000000       0.15909091 1.0 
      0.00000000       0.00000000       0.17045455 1.0 
      0.00000000       0.00000000       0.18181818 1.0 
     -0.00000000       0.00000000       0.19318182 1.0 
     -0.00000000       0.00000000       0.20454545 1.0 
      0.00000000       0.00000000       0.21590909 1.0 
      0.00000000       0.00000000       0.22727273 1.0 
     -0.00000000       0.00000000       0.23863636 1.0 
     -0.00000000       0.00000000       0.25000000 1.0 
      0.00000000       0.00000000       0.26136364 1.0 
      0.00000000       0.00000000       0.27272727 1.0 
      0.00000000       0.00000000       0.28409091 1.0 
      0.00000000       0.00000000       0.29545455 1.0 
     -0.00000000       0.00000000       0.30681818 1.0 
      0.00000000       0.00000000       0.31818182 1.0 
      0.00000000       0.00000000       0.32954545 1.0 
      0.00000000       0.00000000       0.34090909 1.0 
      0.00000000       0.00000000       0.35227273 1.0 
      0.00000000       0.00000000       0.36363636 1.0 
     -0.00000000       0.00000000       0.37500000 1.0 
     -0.00000000       0.00000000       0.38636364 1.0 
     -0.00000000       0.00000000       0.39772727 1.0 
     -0.00000000       0.00000000       0.40909091 1.0 
      0.00000000       0.00000000       0.42045455 1.0 
      0.00000000       0.00000000       0.43181818 1.0 
      0.00000000       0.00000000       0.44318182 1.0 
      0.00000000       0.00000000       0.45454545 1.0 
      0.00000000       0.00000000       0.46590909 1.0 
     -0.00000000       0.00000000       0.47727273 1.0 
     -0.00000000       0.00000000       0.48863636 1.0 
     -0.00000000       0.00000000       0.50000000 1.0 
     -0.00000000       0.00000000       0.50000000 1.0 
     -0.01047329       0.01047329       0.50000000 1.0 
     -0.02094658       0.02094658       0.50000000 1.0 
     -0.03141987       0.03141987       0.50000000 1.0 
     -0.04189317       0.04189317       0.50000000 1.0 
     -0.05236646       0.05236646       0.50000000 1.0 
     -0.06283975       0.06283975       0.50000000 1.0 
     -0.07331304       0.07331304       0.50000000 1.0 
     -0.08378633       0.08378633       0.50000000 1.0 
     -0.09425962       0.09425962       0.50000000 1.0 
     -0.09425962       0.09425962       0.50000000 1.0 
     -0.10206232       0.10206232       0.49219730 1.0 
     -0.10986502       0.10986502       0.48439460 1.0 
     -0.11766772       0.11766772       0.47659190 1.0 
     -0.12547042       0.12547042       0.46878920 1.0 
     -0.13327312       0.13327312       0.46098650 1.0 
     -0.14107582       0.14107582       0.45318380 1.0 
     -0.14887852       0.14887852       0.44538110 1.0 
     -0.15668122       0.15668122       0.43757840 1.0 
     -0.16448392       0.16448392       0.42977570 1.0 
     -0.17228662       0.17228662       0.42197300 1.0 
     -0.18008932       0.18008932       0.41417031 1.0 
     -0.18789202       0.18789202       0.40636761 1.0 
     -0.19569472       0.19569472       0.39856491 1.0 
     -0.20349742       0.20349742       0.39076221 1.0 
     -0.21130012       0.21130012       0.38295951 1.0 
     -0.21910282       0.21910282       0.37515681 1.0 
     -0.22690552       0.22690552       0.36735411 1.0 
     -0.23470822       0.23470822       0.35955141 1.0 
     -0.24251092       0.24251092       0.35174871 1.0 
     -0.25031362       0.25031362       0.34394601 1.0 
     -0.25811631       0.25811631       0.33614331 1.0 
     -0.26591901       0.26591901       0.32834061 1.0 
     -0.27372171       0.27372171       0.32053791 1.0 
     -0.28152441       0.28152441       0.31273521 1.0 
     -0.28932711       0.28932711       0.30493251 1.0 
     -0.29712981       0.29712981       0.29712981 1.0 
     -0.29712981       0.29712981       0.29712981 1.0 
     -0.28909928       0.28909928       0.28909928 1.0 
     -0.28106874       0.28106874       0.28106874 1.0 
     -0.27303821       0.27303821       0.27303821 1.0 
     -0.26500767       0.26500767       0.26500767 1.0 
     -0.25697713       0.25697713       0.25697713 1.0 
     -0.24894660       0.24894660       0.24894660 1.0 
     -0.24091606       0.24091606       0.24091606 1.0 
     -0.23288553       0.23288553       0.23288553 1.0 
     -0.22485499       0.22485499       0.22485499 1.0 
     -0.21682446       0.21682446       0.21682446 1.0 
     -0.20879392       0.20879392       0.20879392 1.0 
     -0.20076339       0.20076339       0.20076339 1.0 
     -0.19273285       0.19273285       0.19273285 1.0 
     -0.18470232       0.18470232       0.18470232 1.0 
     -0.17667178       0.17667178       0.17667178 1.0 
     -0.16864124       0.16864124       0.16864124 1.0 
     -0.16061071       0.16061071       0.16061071 1.0 
     -0.15258017       0.15258017       0.15258017 1.0 
     -0.14454964       0.14454964       0.14454964 1.0 
     -0.13651910       0.13651910       0.13651910 1.0 
     -0.12848857       0.12848857       0.12848857 1.0 
     -0.12045803       0.12045803       0.12045803 1.0 
     -0.11242750       0.11242750       0.11242750 1.0 
     -0.10439696       0.10439696       0.10439696 1.0 
     -0.09636643       0.09636643       0.09636643 1.0 
     -0.08833589       0.08833589       0.08833589 1.0 
     -0.08030535       0.08030535       0.08030535 1.0 
     -0.07227482       0.07227482       0.07227482 1.0 
     -0.06424428       0.06424428       0.06424428 1.0 
     -0.05621375       0.05621375       0.05621375 1.0 
     -0.04818321       0.04818321       0.04818321 1.0 
     -0.04015268       0.04015268       0.04015268 1.0 
     -0.03212214       0.03212214       0.03212214 1.0 
     -0.02409161       0.02409161       0.02409161 1.0 
     -0.01606107       0.01606107       0.01606107 1.0 
     -0.00803054       0.00803054       0.00803054 1.0 
      0.00000000       0.00000000       0.00000000 1.0 
      0.00000000       0.00000000       0.00000000 1.0 
      0.01851852       0.01851852      -0.01851852 1.0 
      0.03703704       0.03703704      -0.03703704 1.0 
      0.05555556       0.05555556      -0.05555556 1.0 
      0.07407407       0.07407407      -0.07407407 1.0 
      0.09259259       0.09259259      -0.09259259 1.0 
      0.11111111       0.11111111      -0.11111111 1.0 
      0.12962963       0.12962963      -0.12962963 1.0 
      0.14814815       0.14814815      -0.14814815 1.0 
      0.16666667       0.16666667      -0.16666667 1.0 
      0.18518519       0.18518519      -0.18518519 1.0 
      0.20370370       0.20370370      -0.20370370 1.0 
      0.22222222       0.22222222      -0.22222222 1.0 
      0.24074074       0.24074074      -0.24074074 1.0 
      0.25925926       0.25925926      -0.25925926 1.0 
      0.27777778       0.27777778      -0.27777778 1.0 
      0.29629630       0.29629630      -0.29629630 1.0 
      0.31481481       0.31481481      -0.31481481 1.0 
      0.33333333       0.33333333      -0.33333333 1.0 
      0.35185185       0.35185185      -0.35185185 1.0 
      0.37037037       0.37037037      -0.37037037 1.0 
      0.38888889       0.38888889      -0.38888889 1.0 
      0.40740741       0.40740741      -0.40740741 1.0 
      0.42592593       0.42592593      -0.42592593 1.0 
      0.44444444       0.44444444      -0.44444444 1.0 
      0.46296296       0.46296296      -0.46296296 1.0 
      0.48148148       0.48148148      -0.48148148 1.0 
      0.50000000       0.50000000      -0.50000000 1.0 
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      0.49219730       0.50780270      -0.49219730 1.0 
      0.48439460       0.51560540      -0.48439460 1.0 
      0.47659190       0.52340810      -0.47659190 1.0 
      0.46878920       0.53121080      -0.46878920 1.0 
      0.46098650       0.53901350      -0.46098650 1.0 
      0.45318380       0.54681620      -0.45318380 1.0 
      0.44538110       0.55461890      -0.44538110 1.0 
      0.43757840       0.56242160      -0.43757840 1.0 
      0.42977570       0.57022430      -0.42977570 1.0 
      0.42197300       0.57802700      -0.42197300 1.0 
      0.41417031       0.58582969      -0.41417031 1.0 
      0.40636761       0.59363239      -0.40636761 1.0 
      0.39856491       0.60143509      -0.39856491 1.0 
      0.39076221       0.60923779      -0.39076221 1.0 
      0.38295951       0.61704049      -0.38295951 1.0 
      0.37515681       0.62484319      -0.37515681 1.0 
      0.36735411       0.63264589      -0.36735411 1.0 
      0.35955141       0.64044859      -0.35955141 1.0 
      0.35174871       0.64825129      -0.35174871 1.0 
      0.34394601       0.65605399      -0.34394601 1.0 
      0.33614331       0.66385669      -0.33614331 1.0 
      0.32834061       0.67165939      -0.32834061 1.0 
      0.32053791       0.67946209      -0.32053791 1.0 
      0.31273521       0.68726479      -0.31273521 1.0 
      0.30493251       0.69506749      -0.30493251 1.0 
      0.29712981       0.70287019      -0.29712981 1.0 
      0.29712981       0.70287019      -0.29712981 1.0 
      0.27732116       0.68934551      -0.27732116 1.0 
      0.25751250       0.67582083      -0.25751250 1.0 
      0.23770385       0.66229615      -0.23770385 1.0 
      0.21789520       0.64877147      -0.21789520 1.0 
      0.19808654       0.63524679      -0.19808654 1.0 
      0.17827789       0.62172211      -0.17827789 1.0 
      0.15846923       0.60819743      -0.15846923 1.0 
      0.13866058       0.59467275      -0.13866058 1.0 
      0.11885192       0.58114808      -0.11885192 1.0 
      0.09904327       0.56762340      -0.09904327 1.0 
      0.07923462       0.55409872      -0.07923462 1.0 
      0.05942596       0.54057404      -0.05942596 1.0 
      0.03961731       0.52704936      -0.03961731 1.0 
      0.01980865       0.51352468      -0.01980865 1.0 
      0.00000000       0.50000000       0.00000000 1.0 
      0.00000000       0.50000000       0.00000000 1.0 
      0.00806452       0.49193548       0.00806452 1.0 
      0.01612903       0.48387097       0.01612903 1.0 
      0.02419355       0.47580645       0.02419355 1.0 
      0.03225806       0.46774194       0.03225806 1.0 
      0.04032258       0.45967742       0.04032258 1.0 
      0.04838710       0.45161290       0.04838710 1.0 
      0.05645161       0.44354839       0.05645161 1.0 
      0.06451613       0.43548387       0.06451613 1.0 
      0.07258065       0.42741935       0.07258065 1.0 
      0.08064516       0.41935484       0.08064516 1.0 
      0.08870968       0.41129032       0.08870968 1.0 
      0.09677419       0.40322581       0.09677419 1.0 
      0.10483871       0.39516129       0.10483871 1.0 
      0.11290323       0.38709677       0.11290323 1.0 
      0.12096774       0.37903226       0.12096774 1.0 
      0.12903226       0.37096774       0.12903226 1.0 
      0.13709677       0.36290323       0.13709677 1.0 
      0.14516129       0.35483871       0.14516129 1.0 
      0.15322581       0.34677419       0.15322581 1.0 
      0.16129032       0.33870968       0.16129032 1.0 
      0.16935484       0.33064516       0.16935484 1.0 
      0.17741935       0.32258065       0.17741935 1.0 
      0.18548387       0.31451613       0.18548387 1.0 
      0.19354839       0.30645161       0.19354839 1.0 
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      0.22580645       0.27419355       0.22580645 1.0 
      0.23387097       0.26612903       0.23387097 1.0 
      0.24193548       0.25806452       0.24193548 1.0 
      0.25000000       0.25000000       0.25000000 1.0 
      0.25000000       0.25000000       0.25000000 1.0 
      0.26562500       0.26562500       0.22848377 1.0 
      0.28125000       0.28125000       0.20696755 1.0 
      0.29687500       0.29687500       0.18545132 1.0 
      0.31250000       0.31250000       0.16393509 1.0 
      0.32812500       0.32812500       0.14241887 1.0 
      0.34375000       0.34375000       0.12090264 1.0 
      0.35937500       0.35937500       0.09938641 1.0 
      0.37500000       0.37500000       0.07787019 1.0 
      0.39062500       0.39062500       0.05635396 1.0 
      0.40625000       0.40625000       0.03483773 1.0 
      0.42187500       0.42187500       0.01332151 1.0 
      0.43750000       0.43750000      -0.00819472 1.0 
      0.45312500       0.45312500      -0.02971094 1.0 
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     -0.00000000       0.00000000       0.50000000 1.0 
      0.01785714       0.01785714       0.48214286 1.0 
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      0.05357143       0.05357143       0.44642857 1.0 
      0.07142857       0.07142857       0.42857143 1.0 
      0.08928571       0.08928571       0.41071429 1.0 
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      0.14285714       0.14285714       0.35714286 1.0 
      0.16071429       0.16071429       0.33928571 1.0 
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      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 

