! Pwscf input file created with ciftopw.py 
! Compound: AsPO4
&control
         calculation     = 'bands'
         prefix          = 'AsPO4'
         restart_mode    = 'from_scratch'
         outdir          = './'
         wf_collect      = .true.
         verbosity       = 'high'
       /
&system
         ibrav           =  14
         celldm(1)       =            9.4919046701481005
         celldm(2)       =            1.4342113121901690
         celldm(3)       =            1.6786119572358598
         celldm(4)       =            0.0000000000000001
         celldm(5)       =            0.0000000000000001
         celldm(6)       =            0.0000000000000001
         nat             =       24
         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 
As  74.9216 As.rel-pbe-n-rrkjus_psl.1.0.0.UPF 
 P  30.9738 P.rel-pbe-n-rrkjus_psl.1.0.0.UPF 
ATOMIC_POSITIONS crystal
K_POINTS crystal
304
      0.00000000       0.00000000       0.00000000 1.0 
      0.01562500       0.00000000       0.00000000 1.0 
      0.03125000       0.00000000       0.00000000 1.0 
      0.04687500      -0.00000000       0.00000000 1.0 
      0.06250000       0.00000000       0.00000000 1.0 
      0.07812500      -0.00000000       0.00000000 1.0 
      0.09375000      -0.00000000       0.00000000 1.0 
      0.10937500       0.00000000       0.00000000 1.0 
      0.12500000       0.00000000       0.00000000 1.0 
      0.14062500      -0.00000000       0.00000000 1.0 
      0.15625000      -0.00000000       0.00000000 1.0 
      0.17187500      -0.00000000       0.00000000 1.0 
      0.18750000      -0.00000000       0.00000000 1.0 
      0.20312500      -0.00000000       0.00000000 1.0 
      0.21875000       0.00000000       0.00000000 1.0 
      0.23437500      -0.00000000       0.00000000 1.0 
      0.25000000       0.00000000       0.00000000 1.0 
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      0.31250000      -0.00000000       0.00000000 1.0 
      0.32812500      -0.00000000       0.00000000 1.0 
      0.34375000      -0.00000000       0.00000000 1.0 
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      0.40625000      -0.00000000       0.00000000 1.0 
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      0.50000000       0.36363636       0.00000000 1.0 
      0.50000000       0.38636364       0.00000000 1.0 
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      0.50000000       0.43181818       0.00000000 1.0 
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      0.46875000       0.50000000       0.00000000 1.0 
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      0.43750000       0.50000000       0.00000000 1.0 
      0.42187500       0.50000000       0.00000000 1.0 
      0.40625000       0.50000000       0.00000000 1.0 
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      0.37500000       0.50000000       0.00000000 1.0 
      0.35937500       0.50000000       0.00000000 1.0 
      0.34375000       0.50000000       0.00000000 1.0 
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      0.31250000       0.50000000       0.00000000 1.0 
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      0.28125000       0.50000000       0.00000000 1.0 
      0.26562500       0.50000000       0.00000000 1.0 
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      0.23437500       0.50000000       0.00000000 1.0 
      0.21875000       0.50000000       0.00000000 1.0 
      0.20312500       0.50000000       0.00000000 1.0 
      0.18750000       0.50000000       0.00000000 1.0 
      0.17187500       0.50000000       0.00000000 1.0 
      0.15625000       0.50000000       0.00000000 1.0 
      0.14062500       0.50000000       0.00000000 1.0 
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      0.09375000       0.50000000       0.00000000 1.0 
      0.07812500       0.50000000       0.00000000 1.0 
      0.06250000       0.50000000       0.00000000 1.0 
      0.04687500       0.50000000       0.00000000 1.0 
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      0.01562500       0.50000000       0.00000000 1.0 
      0.00000000       0.50000000       0.00000000 1.0 
      0.00000000       0.50000000       0.00000000 1.0 
      0.00000000       0.47727273       0.00000000 1.0 
      0.00000000       0.45454545       0.00000000 1.0 
      0.00000000       0.43181818       0.00000000 1.0 
      0.00000000       0.40909091       0.00000000 1.0 
      0.00000000       0.38636364       0.00000000 1.0 
      0.00000000       0.36363636       0.00000000 1.0 
      0.00000000       0.34090909       0.00000000 1.0 
      0.00000000       0.31818182       0.00000000 1.0 
      0.00000000       0.29545455       0.00000000 1.0 
      0.00000000       0.27272727       0.00000000 1.0 
      0.00000000       0.25000000       0.00000000 1.0 
      0.00000000       0.22727273       0.00000000 1.0 
      0.00000000       0.20454545       0.00000000 1.0 
      0.00000000       0.18181818       0.00000000 1.0 
      0.00000000       0.15909091       0.00000000 1.0 
      0.00000000       0.13636364       0.00000000 1.0 
      0.00000000       0.11363636       0.00000000 1.0 
      0.00000000       0.09090909       0.00000000 1.0 
      0.00000000       0.06818182       0.00000000 1.0 
      0.00000000       0.04545455       0.00000000 1.0 
      0.00000000       0.02272727       0.00000000 1.0 
      0.00000000       0.00000000       0.00000000 1.0 
      0.00000000       0.00000000       0.00000000 1.0 
      0.00000000       0.00000000       0.02631579 1.0 
      0.00000000       0.00000000       0.05263158 1.0 
      0.00000000       0.00000000       0.07894737 1.0 
      0.00000000       0.00000000       0.10526316 1.0 
     -0.00000000       0.00000000       0.13157895 1.0 
      0.00000000       0.00000000       0.15789474 1.0 
      0.00000000       0.00000000       0.18421053 1.0 
      0.00000000       0.00000000       0.21052632 1.0 
      0.00000000       0.00000000       0.23684211 1.0 
     -0.00000000       0.00000000       0.26315789 1.0 
      0.00000000       0.00000000       0.28947368 1.0 
      0.00000000       0.00000000       0.31578947 1.0 
      0.00000000       0.00000000       0.34210526 1.0 
      0.00000000       0.00000000       0.36842105 1.0 
      0.00000000       0.00000000       0.39473684 1.0 
      0.00000000       0.00000000       0.42105263 1.0 
      0.00000000       0.00000000       0.44736842 1.0 
      0.00000000       0.00000000       0.47368421 1.0 
      0.00000000       0.00000000       0.50000000 1.0 
      0.00000000       0.00000000       0.50000000 1.0 
      0.01562500      -0.00000000       0.50000000 1.0 
      0.03125000       0.00000000       0.50000000 1.0 
      0.04687500       0.00000000       0.50000000 1.0 
      0.06250000      -0.00000000       0.50000000 1.0 
      0.07812500       0.00000000       0.50000000 1.0 
      0.09375000      -0.00000000       0.50000000 1.0 
      0.10937500      -0.00000000       0.50000000 1.0 
      0.12500000      -0.00000000       0.50000000 1.0 
      0.14062500      -0.00000000       0.50000000 1.0 
      0.15625000      -0.00000000       0.50000000 1.0 
      0.17187500      -0.00000000       0.50000000 1.0 
      0.18750000      -0.00000000       0.50000000 1.0 
      0.20312500      -0.00000000       0.50000000 1.0 
      0.21875000       0.00000000       0.50000000 1.0 
      0.23437500      -0.00000000       0.50000000 1.0 
      0.25000000      -0.00000000       0.50000000 1.0 
      0.26562500      -0.00000000       0.50000000 1.0 
      0.28125000      -0.00000000       0.50000000 1.0 
      0.29687500      -0.00000000       0.50000000 1.0 
      0.31250000      -0.00000000       0.50000000 1.0 
      0.32812500      -0.00000000       0.50000000 1.0 
      0.34375000      -0.00000000       0.50000000 1.0 
      0.35937500      -0.00000000       0.50000000 1.0 
      0.37500000      -0.00000000       0.50000000 1.0 
      0.39062500      -0.00000000       0.50000000 1.0 
      0.40625000      -0.00000000       0.50000000 1.0 
      0.42187500      -0.00000000       0.50000000 1.0 
      0.43750000       0.00000000       0.50000000 1.0 
      0.45312500      -0.00000000       0.50000000 1.0 
      0.46875000      -0.00000000       0.50000000 1.0 
      0.48437500       0.00000000       0.50000000 1.0 
      0.50000000      -0.00000000       0.50000000 1.0 
      0.50000000      -0.00000000       0.50000000 1.0 
      0.50000000       0.02272727       0.50000000 1.0 
      0.50000000       0.04545455       0.50000000 1.0 
      0.50000000       0.06818182       0.50000000 1.0 
      0.50000000       0.09090909       0.50000000 1.0 
      0.50000000       0.11363636       0.50000000 1.0 
      0.50000000       0.13636364       0.50000000 1.0 
      0.50000000       0.15909091       0.50000000 1.0 
      0.50000000       0.18181818       0.50000000 1.0 
      0.50000000       0.20454545       0.50000000 1.0 
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      0.50000000       0.25000000       0.50000000 1.0 
      0.50000000       0.27272727       0.50000000 1.0 
      0.50000000       0.29545455       0.50000000 1.0 
      0.50000000       0.31818182       0.50000000 1.0 
      0.50000000       0.34090909       0.50000000 1.0 
      0.50000000       0.36363636       0.50000000 1.0 
      0.50000000       0.38636364       0.50000000 1.0 
      0.50000000       0.40909091       0.50000000 1.0 
      0.50000000       0.43181818       0.50000000 1.0 
      0.50000000       0.45454545       0.50000000 1.0 
      0.50000000       0.47727273       0.50000000 1.0 
      0.50000000       0.50000000       0.50000000 1.0 
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      0.48437500       0.50000000       0.50000000 1.0 
      0.46875000       0.50000000       0.50000000 1.0 
      0.45312500       0.50000000       0.50000000 1.0 
      0.43750000       0.50000000       0.50000000 1.0 
      0.42187500       0.50000000       0.50000000 1.0 
      0.40625000       0.50000000       0.50000000 1.0 
      0.39062500       0.50000000       0.50000000 1.0 
      0.37500000       0.50000000       0.50000000 1.0 
      0.35937500       0.50000000       0.50000000 1.0 
      0.34375000       0.50000000       0.50000000 1.0 
      0.32812500       0.50000000       0.50000000 1.0 
      0.31250000       0.50000000       0.50000000 1.0 
      0.29687500       0.50000000       0.50000000 1.0 
      0.28125000       0.50000000       0.50000000 1.0 
      0.26562500       0.50000000       0.50000000 1.0 
      0.25000000       0.50000000       0.50000000 1.0 
      0.23437500       0.50000000       0.50000000 1.0 
      0.21875000       0.50000000       0.50000000 1.0 
      0.20312500       0.50000000       0.50000000 1.0 
      0.18750000       0.50000000       0.50000000 1.0 
      0.17187500       0.50000000       0.50000000 1.0 
      0.15625000       0.50000000       0.50000000 1.0 
      0.14062500       0.50000000       0.50000000 1.0 
      0.12500000       0.50000000       0.50000000 1.0 
      0.10937500       0.50000000       0.50000000 1.0 
      0.09375000       0.50000000       0.50000000 1.0 
      0.07812500       0.50000000       0.50000000 1.0 
      0.06250000       0.50000000       0.50000000 1.0 
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      0.03125000       0.50000000       0.50000000 1.0 
      0.01562500       0.50000000       0.50000000 1.0 
      0.00000000       0.50000000       0.50000000 1.0 
      0.00000000       0.50000000       0.50000000 1.0 
      0.00000000       0.47727273       0.50000000 1.0 
      0.00000000       0.45454545       0.50000000 1.0 
      0.00000000       0.43181818       0.50000000 1.0 
      0.00000000       0.40909091       0.50000000 1.0 
      0.00000000       0.38636364       0.50000000 1.0 
      0.00000000       0.36363636       0.50000000 1.0 
      0.00000000       0.34090909       0.50000000 1.0 
      0.00000000       0.31818182       0.50000000 1.0 
      0.00000000       0.29545455       0.50000000 1.0 
      0.00000000       0.27272727       0.50000000 1.0 
      0.00000000       0.25000000       0.50000000 1.0 
      0.00000000       0.22727273       0.50000000 1.0 
      0.00000000       0.20454545       0.50000000 1.0 
      0.00000000       0.18181818       0.50000000 1.0 
      0.00000000       0.15909091       0.50000000 1.0 
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      0.00000000       0.11363636       0.50000000 1.0 
      0.00000000       0.09090909       0.50000000 1.0 
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      0.00000000       0.04545455       0.50000000 1.0 
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      0.00000000       0.50000000       0.31578947 1.0 
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      0.00000000       0.50000000       0.36842105 1.0 
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      0.50000000       0.50000000       0.44736842 1.0 
      0.50000000       0.50000000       0.47368421 1.0 
      0.50000000       0.50000000       0.50000000 1.0 

