! Pwscf input file created with ciftopw.py 
! Compound: CsAuCl4
&control
         calculation     = 'bands'
         prefix          = 'CsAuCl4'
         restart_mode    = 'from_scratch'
         outdir          = './'
         wf_collect      = .true.
         verbosity       = 'high'
       /
&system
         ibrav           =  14
         celldm(1)       =           13.5313928490948552
         celldm(2)       =            1.0000000000000000
         celldm(3)       =            1.3478378514638119
         celldm(4)       =            0.2342985930546905
         celldm(5)       =            0.2342985930546905
         celldm(6)       =            0.6285809823285262
         nat             =       12
         ntyp            =        3
         ecutwfc         =       80.00000000
         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
Cl  35.4530 Cl.rel-pbe-n-rrkjus_psl.1.0.0.UPF 
Au 196.9666 Au.rel-pbe-n-rrkjus_psl.1.0.0.UPF 
Cs 132.9055 Cs.rel-pbe-oncvpsp.UPF 
ATOMIC_POSITIONS crystal
K_POINTS crystal
242
      0.00000000       0.00000000       0.00000000 1.0 
      0.01923077       0.01923077      -0.00000000 1.0 
      0.03846154       0.03846154      -0.00000000 1.0 
      0.05769231       0.05769231      -0.00000000 1.0 
      0.07692308       0.07692308      -0.00000000 1.0 
      0.09615385       0.09615385      -0.00000000 1.0 
      0.11538462       0.11538462      -0.00000000 1.0 
      0.13461538       0.13461538      -0.00000000 1.0 
      0.15384615       0.15384615      -0.00000000 1.0 
      0.17307692       0.17307692      -0.00000000 1.0 
      0.19230769       0.19230769      -0.00000000 1.0 
      0.21153846       0.21153846       0.00000000 1.0 
      0.23076923       0.23076923      -0.00000000 1.0 
      0.25000000       0.25000000      -0.00000000 1.0 
      0.26923077       0.26923077      -0.00000000 1.0 
      0.28846154       0.28846154       0.00000000 1.0 
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      0.32692308       0.32692308      -0.00000000 1.0 
      0.34615385       0.34615385      -0.00000000 1.0 
      0.36538462       0.36538462      -0.00000000 1.0 
      0.38461538       0.38461538      -0.00000000 1.0 
      0.40384615       0.40384615      -0.00000000 1.0 
      0.42307692       0.42307692       0.00000000 1.0 
      0.44230769       0.44230769      -0.00000000 1.0 
      0.46153846       0.46153846      -0.00000000 1.0 
      0.48076923       0.48076923      -0.00000000 1.0 
      0.50000000       0.50000000      -0.00000000 1.0 
      0.50000000       0.50000000      -0.00000000 1.0 
      0.50518683       0.50518683       0.02983800 1.0 
      0.51037365       0.51037365       0.05967600 1.0 
      0.51556048       0.51556048       0.08951400 1.0 
      0.52074731       0.52074731       0.11935200 1.0 
      0.52593413       0.52593413       0.14919000 1.0 
      0.53112096       0.53112096       0.17902799 1.0 
      0.53630779       0.53630779       0.20886599 1.0 
      0.54149461       0.54149461       0.23870399 1.0 
      0.54668144       0.54668144       0.26854199 1.0 
      0.55186827       0.55186827       0.29837999 1.0 
      0.55705509       0.55705509       0.32821799 1.0 
      0.55705509       0.55705509       0.32821799 1.0 
      0.54992321       0.54992321       0.34969074 1.0 
      0.54279132       0.54279132       0.37116349 1.0 
      0.53565943       0.53565943       0.39263624 1.0 
      0.52852755       0.52852755       0.41410900 1.0 
      0.52139566       0.52139566       0.43558175 1.0 
      0.51426377       0.51426377       0.45705450 1.0 
      0.50713189       0.50713189       0.47852725 1.0 
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      0.58595737       0.41404263       0.50000000 1.0 
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      0.12561553      -0.12561553       0.50000000 1.0 
      0.11595279      -0.11595279       0.50000000 1.0 
      0.10629006      -0.10629006       0.50000000 1.0 
      0.09662733      -0.09662733       0.50000000 1.0 
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      0.07730186      -0.07730186       0.50000000 1.0 
      0.06763913      -0.06763913       0.50000000 1.0 
      0.05797640      -0.05797640       0.50000000 1.0 
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      0.03865093      -0.03865093       0.50000000 1.0 
      0.02898820      -0.02898820       0.50000000 1.0 
      0.01932547      -0.01932547       0.50000000 1.0 
      0.00966273      -0.00966273       0.50000000 1.0 
      0.00000000       0.00000000       0.50000000 1.0 
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      0.02013386       0.02013386       0.50780827 1.0 
      0.04026772       0.04026772       0.51561655 1.0 
      0.06040158       0.06040158       0.52342482 1.0 
      0.08053544       0.08053544       0.53123309 1.0 
      0.10066930       0.10066930       0.53904137 1.0 
      0.12080316       0.12080316       0.54684964 1.0 
      0.14093702       0.14093702       0.55465791 1.0 
      0.16107088       0.16107088       0.56246619 1.0 
      0.18120473       0.18120473       0.57027446 1.0 
      0.20133859       0.20133859       0.57808273 1.0 
      0.22147245       0.22147245       0.58589100 1.0 
      0.24160631       0.24160631       0.59369928 1.0 
      0.26174017       0.26174017       0.60150755 1.0 
      0.28187403       0.28187403       0.60931582 1.0 
      0.30200789       0.30200789       0.61712410 1.0 
      0.32214175       0.32214175       0.62493237 1.0 
      0.34227561       0.34227561       0.63274064 1.0 
      0.36240947       0.36240947       0.64054892 1.0 
      0.38254333       0.38254333       0.64835719 1.0 
      0.40267719       0.40267719       0.65616546 1.0 
      0.42281105       0.42281105       0.66397374 1.0 
      0.44294491       0.44294491       0.67178201 1.0 
      0.50000000       0.50000000      -0.00000000 1.0 
      0.50944313       0.49055687      -0.00000000 1.0 
      0.51888626       0.48111374      -0.00000000 1.0 
      0.52832940       0.47167060      -0.00000000 1.0 
      0.53777253       0.46222747      -0.00000000 1.0 
      0.54721566       0.45278434      -0.00000000 1.0 
      0.55665879       0.44334121      -0.00000000 1.0 
      0.56610193       0.43389807      -0.00000000 1.0 
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      0.60387446       0.39612554      -0.00000000 1.0 
      0.61331759       0.38668241      -0.00000000 1.0 
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