! Pwscf input file created with ciftopw.py 
! Compound: AgTe4Au
&control
         calculation     = 'bands'
         prefix          = 'AgTe4Au'
         restart_mode    = 'from_scratch'
         outdir          = './'
         wf_collect      = .true.
         verbosity       = 'high'
       /
&system
         ibrav           =  14
         celldm(1)       =            8.4621929787419994
         celldm(2)       =            1.9793672590894968
         celldm(3)       =            2.2728453556896375
         celldm(4)       =            0.5656045369860030
         celldm(5)       =            0.0000000000000001
         celldm(6)       =            0.0000000000000001
         nat             =       12
         ntyp            =        3
         ecutwfc         =       46.00000000
         ecutrho         =      424.00000000
         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
Ag 107.8682 Ag.rel-pbe-n-rrkjus_psl.1.0.0.UPF 
Te 127.6000 Te.rel-pbe-n-rrkjus_psl.1.0.0.UPF 
Au 196.9666 Au.rel-pbe-n-rrkjus_psl.1.0.0.UPF 
ATOMIC_POSITIONS crystal
K_POINTS crystal
227
      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 
      0.00000000       0.02664706       0.51730636 1.0 
      0.00000000       0.05329413       0.53461272 1.0 
      0.00000000       0.07994119       0.55191908 1.0 
      0.00000000       0.10658826       0.56922545 1.0 
      0.00000000       0.13323532       0.58653181 1.0 
      0.00000000       0.15988239       0.60383817 1.0 
      0.00000000       0.18652945       0.62114453 1.0 
      0.00000000       0.21317652       0.63845089 1.0 
      0.00000000       0.23982358       0.65575725 1.0 
      0.00000000       0.26647065       0.67306361 1.0 
      0.00000000       0.29311771       0.69036997 1.0 
      0.00000000       0.31976478       0.70767634 1.0 
      0.00000000       0.34641184       0.72498270 1.0 
      0.00000000       0.37305891       0.74228906 1.0 
      0.00000000       0.37305891       0.74228906 1.0 
      0.00000000       0.38282361       0.72365144 1.0 
      0.00000000       0.39258830       0.70501382 1.0 
      0.00000000       0.40235300       0.68637620 1.0 
      0.00000000       0.41211770       0.66773858 1.0 
      0.00000000       0.42188240       0.64910096 1.0 
      0.00000000       0.43164710       0.63046334 1.0 
      0.00000000       0.44141180       0.61182572 1.0 
      0.00000000       0.45117650       0.59318810 1.0 
      0.00000000       0.46094120       0.57455048 1.0 
      0.00000000       0.47070590       0.55591286 1.0 
      0.00000000       0.48047060       0.53727524 1.0 
      0.00000000       0.49023530       0.51863762 1.0 
      0.00000000       0.50000000       0.50000000 1.0 
      0.00000000       0.50000000       0.50000000 1.0 
      0.01388889       0.50000000       0.50000000 1.0 
      0.02777778       0.50000000       0.50000000 1.0 
      0.04166667       0.50000000       0.50000000 1.0 
      0.05555556       0.50000000       0.50000000 1.0 
      0.06944444       0.50000000       0.50000000 1.0 
      0.08333333       0.50000000       0.50000000 1.0 
      0.09722222       0.50000000       0.50000000 1.0 
      0.11111111       0.50000000       0.50000000 1.0 
      0.12500000       0.50000000       0.50000000 1.0 
      0.13888889       0.50000000       0.50000000 1.0 
      0.15277778       0.50000000       0.50000000 1.0 
      0.16666667       0.50000000       0.50000000 1.0 
      0.18055556       0.50000000       0.50000000 1.0 
      0.19444444       0.50000000       0.50000000 1.0 
      0.20833333       0.50000000       0.50000000 1.0 
      0.22222222       0.50000000       0.50000000 1.0 
      0.23611111       0.50000000       0.50000000 1.0 
      0.25000000       0.50000000       0.50000000 1.0 
      0.26388889       0.50000000       0.50000000 1.0 
      0.27777778       0.50000000       0.50000000 1.0 
      0.29166667       0.50000000       0.50000000 1.0 
      0.30555556       0.50000000       0.50000000 1.0 
      0.31944444       0.50000000       0.50000000 1.0 
      0.33333333       0.50000000       0.50000000 1.0 
      0.34722222       0.50000000       0.50000000 1.0 
      0.36111111       0.50000000       0.50000000 1.0 
      0.37500000       0.50000000       0.50000000 1.0 
      0.38888889       0.50000000       0.50000000 1.0 
      0.40277778       0.50000000       0.50000000 1.0 
      0.41666667       0.50000000       0.50000000 1.0 
      0.43055556       0.50000000       0.50000000 1.0 
      0.44444444       0.50000000       0.50000000 1.0 
      0.45833333       0.50000000       0.50000000 1.0 
      0.47222222       0.50000000       0.50000000 1.0 
      0.48611111       0.50000000       0.50000000 1.0 
      0.50000000       0.50000000       0.50000000 1.0 
      0.50000000       0.50000000       0.50000000 1.0 
      0.50000000       0.50976470       0.48136238 1.0 
      0.50000000       0.51952940       0.46272476 1.0 
      0.50000000       0.52929410       0.44408714 1.0 
      0.50000000       0.53905880       0.42544952 1.0 
      0.50000000       0.54882350       0.40681190 1.0 
      0.50000000       0.55858820       0.38817428 1.0 
      0.50000000       0.56835290       0.36953666 1.0 
      0.50000000       0.57811760       0.35089904 1.0 
      0.50000000       0.58788230       0.33226142 1.0 
      0.50000000       0.59764700       0.31362380 1.0 
      0.50000000       0.60741170       0.29498618 1.0 
      0.50000000       0.61717639       0.27634856 1.0 
      0.50000000       0.62694109       0.25771094 1.0 
      0.50000000       0.62694109       0.25771094 1.0 
      0.50000000       0.61107346       0.22549707 1.0 
      0.50000000       0.59520582       0.19328321 1.0 
      0.50000000       0.57933818       0.16106934 1.0 
      0.50000000       0.56347055       0.12885547 1.0 
      0.50000000       0.54760291       0.09664160 1.0 
      0.50000000       0.53173527       0.06442774 1.0 
      0.50000000       0.51586764       0.03221387 1.0 
      0.50000000       0.50000000       0.00000000 1.0 
      0.50000000       0.50000000       0.00000000 1.0 
      0.48611111       0.50000000       0.00000000 1.0 
      0.47222222       0.50000000       0.00000000 1.0 
      0.45833333       0.50000000       0.00000000 1.0 
      0.44444444       0.50000000       0.00000000 1.0 
      0.43055556       0.50000000       0.00000000 1.0 
      0.41666667       0.50000000       0.00000000 1.0 
      0.40277778       0.50000000       0.00000000 1.0 
      0.38888889       0.50000000       0.00000000 1.0 
      0.37500000       0.50000000       0.00000000 1.0 
      0.36111111       0.50000000       0.00000000 1.0 
      0.34722222       0.50000000       0.00000000 1.0 
      0.33333333       0.50000000       0.00000000 1.0 
      0.31944444       0.50000000       0.00000000 1.0 
      0.30555556       0.50000000       0.00000000 1.0 
      0.29166667       0.50000000       0.00000000 1.0 
      0.27777778       0.50000000       0.00000000 1.0 
      0.26388889       0.50000000       0.00000000 1.0 
      0.25000000       0.50000000       0.00000000 1.0 
      0.23611111       0.50000000       0.00000000 1.0 
      0.22222222       0.50000000       0.00000000 1.0 
      0.20833333       0.50000000       0.00000000 1.0 
      0.19444444       0.50000000       0.00000000 1.0 
      0.18055556       0.50000000       0.00000000 1.0 
      0.16666667       0.50000000       0.00000000 1.0 
      0.15277778       0.50000000       0.00000000 1.0 
      0.13888889       0.50000000       0.00000000 1.0 
      0.12500000       0.50000000       0.00000000 1.0 
      0.11111111       0.50000000       0.00000000 1.0 
      0.09722222       0.50000000       0.00000000 1.0 
      0.08333333       0.50000000       0.00000000 1.0 
      0.06944444       0.50000000       0.00000000 1.0 
      0.05555556       0.50000000       0.00000000 1.0 
      0.04166667       0.50000000       0.00000000 1.0 
      0.02777778       0.50000000       0.00000000 1.0 
      0.01388889       0.50000000       0.00000000 1.0 
      0.00000000       0.50000000       0.00000000 1.0 
      0.00000000       0.50000000       0.00000000 1.0 
      0.00000000       0.51586764       0.03221387 1.0 
      0.00000000       0.53173527       0.06442774 1.0 
      0.00000000       0.54760291       0.09664160 1.0 
      0.00000000       0.56347055       0.12885547 1.0 
      0.00000000       0.57933818       0.16106934 1.0 
      0.00000000       0.59520582       0.19328321 1.0 
      0.00000000       0.61107346       0.22549707 1.0 
      0.00000000       0.62694109       0.25771094 1.0 
      0.50000000       0.37305891       0.74228906 1.0 
      0.50000000       0.34641184       0.72498270 1.0 
      0.50000000       0.31976478       0.70767634 1.0 
      0.50000000       0.29311771       0.69036997 1.0 
      0.50000000       0.26647065       0.67306361 1.0 
      0.50000000       0.23982358       0.65575725 1.0 
      0.50000000       0.21317652       0.63845089 1.0 
      0.50000000       0.18652945       0.62114453 1.0 
      0.50000000       0.15988239       0.60383817 1.0 
      0.50000000       0.13323532       0.58653181 1.0 
      0.50000000       0.10658826       0.56922545 1.0 
      0.50000000       0.07994119       0.55191908 1.0 
      0.50000000       0.05329413       0.53461272 1.0 
      0.50000000       0.02664706       0.51730636 1.0 
      0.50000000       0.00000000       0.50000000 1.0 
      0.50000000       0.00000000       0.50000000 1.0 
      0.50000000       0.00000000       0.47368421 1.0 
      0.50000000       0.00000000       0.44736842 1.0 
      0.50000000       0.00000000       0.42105263 1.0 
      0.50000000       0.00000000       0.39473684 1.0 
      0.50000000       0.00000000       0.36842105 1.0 
      0.50000000       0.00000000       0.34210526 1.0 
      0.50000000       0.00000000       0.31578947 1.0 
      0.50000000       0.00000000       0.28947368 1.0 
      0.50000000       0.00000000       0.26315789 1.0 
      0.50000000       0.00000000       0.23684211 1.0 
      0.50000000       0.00000000       0.21052632 1.0 
      0.50000000       0.00000000       0.18421053 1.0 
      0.50000000       0.00000000       0.15789474 1.0 
      0.50000000       0.00000000       0.13157895 1.0 
      0.50000000       0.00000000       0.10526316 1.0 
      0.50000000       0.00000000       0.07894737 1.0 
      0.50000000       0.00000000       0.05263158 1.0 
      0.50000000       0.00000000       0.02631579 1.0 
      0.50000000       0.00000000       0.00000000 1.0 
      0.00000000       0.00000000       0.50000000 1.0 
      0.01388889       0.00000000       0.50000000 1.0 
      0.02777778       0.00000000       0.50000000 1.0 
      0.04166667       0.00000000       0.50000000 1.0 
      0.05555556       0.00000000       0.50000000 1.0 
      0.06944444       0.00000000       0.50000000 1.0 
      0.08333333       0.00000000       0.50000000 1.0 
      0.09722222       0.00000000       0.50000000 1.0 
      0.11111111       0.00000000       0.50000000 1.0 
      0.12500000       0.00000000       0.50000000 1.0 
      0.13888889       0.00000000       0.50000000 1.0 
      0.15277778       0.00000000       0.50000000 1.0 
      0.16666667       0.00000000       0.50000000 1.0 
      0.18055556       0.00000000       0.50000000 1.0 
      0.19444444       0.00000000       0.50000000 1.0 
      0.20833333       0.00000000       0.50000000 1.0 
      0.22222222       0.00000000       0.50000000 1.0 
      0.23611111       0.00000000       0.50000000 1.0 
      0.25000000       0.00000000       0.50000000 1.0 
      0.26388889       0.00000000       0.50000000 1.0 
      0.27777778       0.00000000       0.50000000 1.0 
      0.29166667       0.00000000       0.50000000 1.0 
      0.30555556       0.00000000       0.50000000 1.0 
      0.31944444       0.00000000       0.50000000 1.0 
      0.33333333       0.00000000       0.50000000 1.0 
      0.34722222       0.00000000       0.50000000 1.0 
      0.36111111       0.00000000       0.50000000 1.0 
      0.37500000       0.00000000       0.50000000 1.0 
      0.38888889       0.00000000       0.50000000 1.0 
      0.40277778       0.00000000       0.50000000 1.0 
      0.41666667       0.00000000       0.50000000 1.0 
      0.43055556       0.00000000       0.50000000 1.0 
      0.44444444       0.00000000       0.50000000 1.0 
      0.45833333       0.00000000       0.50000000 1.0 
      0.47222222       0.00000000       0.50000000 1.0 
      0.48611111       0.00000000       0.50000000 1.0 
      0.50000000       0.00000000       0.50000000 1.0 

