! Pwscf input file created with ciftopw.py 
! Compound: AuClO
&control
         calculation     = 'bands'
         prefix          = 'AuClO'
         restart_mode    = 'from_scratch'
         outdir          = './'
         wf_collect      = .true.
         verbosity       = 'high'
       /
&system
         ibrav           =  14
         celldm(1)       =           15.3974873583719987
         celldm(2)       =            1.0000000000000000
         celldm(3)       =            1.0000000000000002
         celldm(4)       =           -0.3979486313076102
         celldm(5)       =           -0.3979486313076102
         celldm(6)       =           -0.3979486313076102
         nat             =       18
         ntyp            =        3
         ecutwfc         =       47.00000000
         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
 O  15.9994 O.rel-pbe-n-rrkjus_psl.1.0.0.UPF 
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 
ATOMIC_POSITIONS crystal
K_POINTS crystal
218
      0.00000000       0.00000000       0.00000000 1.0 
      0.01324692      -0.02379011       0.01324692 1.0 
      0.02649385      -0.04758023       0.02649385 1.0 
      0.03974077      -0.07137034       0.03974077 1.0 
      0.05298769      -0.09516045       0.05298769 1.0 
      0.06623462      -0.11895057       0.06623462 1.0 
      0.07948154      -0.14274068       0.07948154 1.0 
      0.09272846      -0.16653080       0.09272846 1.0 
      0.10597539      -0.19032091       0.10597539 1.0 
      0.11922231      -0.21411102       0.11922231 1.0 
      0.13246923      -0.23790114       0.13246923 1.0 
      0.14571616      -0.26169125       0.14571616 1.0 
      0.15896308      -0.28548136       0.15896308 1.0 
      0.17221000      -0.30927148       0.17221000 1.0 
      0.18545693      -0.33306159       0.18545693 1.0 
      0.19870385      -0.35685170       0.19870385 1.0 
      0.21195078      -0.38064182       0.21195078 1.0 
      0.22519770      -0.40443193       0.22519770 1.0 
      0.23844462      -0.42822204       0.23844462 1.0 
      0.25169155      -0.45201216       0.25169155 1.0 
      0.26493847      -0.47580227       0.26493847 1.0 
      0.27818539      -0.49959239       0.27818539 1.0 
      0.29143232      -0.52338250       0.29143232 1.0 
      0.30467924      -0.54717261       0.30467924 1.0 
      0.31792616      -0.57096273       0.31792616 1.0 
      0.33117309      -0.59475284       0.33117309 1.0 
      0.34442001      -0.61854295       0.34442001 1.0 
      0.35766693      -0.64233307       0.35766693 1.0 
      0.35766693      -0.64233307       0.35766693 1.0 
      0.36413662      -0.63586338       0.36413662 1.0 
      0.37060630      -0.62939370       0.37060630 1.0 
      0.37707599      -0.62292401       0.37707599 1.0 
      0.38354567      -0.61645433       0.38354567 1.0 
      0.39001536      -0.60998464       0.39001536 1.0 
      0.39648504      -0.60351496       0.39648504 1.0 
      0.40295473      -0.59704527       0.40295473 1.0 
      0.40942441      -0.59057559       0.40942441 1.0 
      0.41589410      -0.58410590       0.41589410 1.0 
      0.42236378      -0.57763622       0.42236378 1.0 
      0.42883347      -0.57116653       0.42883347 1.0 
      0.43530315      -0.56469685       0.43530315 1.0 
      0.44177284      -0.55822716       0.44177284 1.0 
      0.44824252      -0.55175748       0.44824252 1.0 
      0.45471221      -0.54528779       0.45471221 1.0 
      0.46118189      -0.53881811       0.46118189 1.0 
      0.46765158      -0.53234842       0.46765158 1.0 
      0.47412126      -0.52587874       0.47412126 1.0 
      0.48059095      -0.51940905       0.48059095 1.0 
      0.48706063      -0.51293937       0.48706063 1.0 
      0.49353032      -0.50646968       0.49353032 1.0 
      0.50000000      -0.50000000       0.50000000 1.0 
      0.50000000      -0.50000000       0.50000000 1.0 
      0.48983335      -0.47445236       0.48983335 1.0 
      0.47966670      -0.44890472       0.47966670 1.0 
      0.46950006      -0.42335709       0.46950006 1.0 
      0.45933341      -0.39780945       0.45933341 1.0 
      0.44916676      -0.37226181       0.44916676 1.0 
      0.43900011      -0.34671417       0.43900011 1.0 
      0.42883347      -0.32116653       0.42883347 1.0 
      0.41866682      -0.29561890       0.41866682 1.0 
      0.40850017      -0.27007126       0.40850017 1.0 
      0.39833352      -0.24452362       0.39833352 1.0 
      0.38816688      -0.21897598       0.38816688 1.0 
      0.37800023      -0.19342834       0.37800023 1.0 
      0.36783358      -0.16788070       0.36783358 1.0 
      0.35766693      -0.14233307       0.35766693 1.0 
      0.34750029      -0.11678543       0.34750029 1.0 
      0.33733364      -0.09123779       0.33733364 1.0 
      0.32716699      -0.06569015       0.32716699 1.0 
      0.31700034      -0.04014251       0.31700034 1.0 
      0.30683370      -0.01459488       0.30683370 1.0 
      0.29666705       0.01095276       0.29666705 1.0 
      0.28650040       0.03650040       0.28650040 1.0 
      0.27633375       0.06204804       0.27633375 1.0 
      0.26616710       0.08759568       0.26616710 1.0 
      0.25600046       0.11314331       0.25600046 1.0 
      0.24583381       0.13869095       0.24583381 1.0 
      0.23566716       0.16423859       0.23566716 1.0 
      0.22550051       0.18978623       0.22550051 1.0 
      0.21533387       0.21533387       0.21533387 1.0 
      0.21533387       0.21533387       0.21533387 1.0 
      0.20860468       0.20860468       0.20860468 1.0 
      0.20187550       0.20187550       0.20187550 1.0 
      0.19514632       0.19514632       0.19514632 1.0 
      0.18841713       0.18841713       0.18841713 1.0 
      0.18168795       0.18168795       0.18168795 1.0 
      0.17495877       0.17495877       0.17495877 1.0 
      0.16822958       0.16822958       0.16822958 1.0 
      0.16150040       0.16150040       0.16150040 1.0 
      0.15477122       0.15477122       0.15477122 1.0 
      0.14804203       0.14804203       0.14804203 1.0 
      0.14131285       0.14131285       0.14131285 1.0 
      0.13458367       0.13458367       0.13458367 1.0 
      0.12785448       0.12785448       0.12785448 1.0 
      0.12112530       0.12112530       0.12112530 1.0 
      0.11439612       0.11439612       0.11439612 1.0 
      0.10766693       0.10766693       0.10766693 1.0 
      0.10093775       0.10093775       0.10093775 1.0 
      0.09420857       0.09420857       0.09420857 1.0 
      0.08747938       0.08747938       0.08747938 1.0 
      0.08075020       0.08075020       0.08075020 1.0 
      0.07402102       0.07402102       0.07402102 1.0 
      0.06729183       0.06729183       0.06729183 1.0 
      0.06056265       0.06056265       0.06056265 1.0 
      0.05383347       0.05383347       0.05383347 1.0 
      0.04710428       0.04710428       0.04710428 1.0 
      0.04037510       0.04037510       0.04037510 1.0 
      0.03364592       0.03364592       0.03364592 1.0 
      0.02691673       0.02691673       0.02691673 1.0 
      0.02018755       0.02018755       0.02018755 1.0 
      0.01345837       0.01345837       0.01345837 1.0 
      0.00672918       0.00672918       0.00672918 1.0 
      0.00000000       0.00000000       0.00000000 1.0 
      0.00000000       0.00000000       0.00000000 1.0 
      0.02083333      -0.02083333       0.00000000 1.0 
      0.04166667      -0.04166667       0.00000000 1.0 
      0.06250000      -0.06250000       0.00000000 1.0 
      0.08333333      -0.08333333       0.00000000 1.0 
      0.10416667      -0.10416667       0.00000000 1.0 
      0.12500000      -0.12500000       0.00000000 1.0 
      0.14583333      -0.14583333       0.00000000 1.0 
      0.16666667      -0.16666667       0.00000000 1.0 
      0.18750000      -0.18750000       0.00000000 1.0 
      0.20833333      -0.20833333       0.00000000 1.0 
      0.22916667      -0.22916667       0.00000000 1.0 
      0.25000000      -0.25000000       0.00000000 1.0 
      0.27083333      -0.27083333       0.00000000 1.0 
      0.29166667      -0.29166667       0.00000000 1.0 
      0.31250000      -0.31250000       0.00000000 1.0 
      0.33333333      -0.33333333       0.00000000 1.0 
      0.35416667      -0.35416667       0.00000000 1.0 
      0.37500000      -0.37500000       0.00000000 1.0 
      0.39583333      -0.39583333       0.00000000 1.0 
      0.41666667      -0.41666667       0.00000000 1.0 
      0.43750000      -0.43750000       0.00000000 1.0 
      0.45833333      -0.45833333       0.00000000 1.0 
      0.47916667      -0.47916667       0.00000000 1.0 
      0.50000000      -0.50000000       0.00000000 1.0 
      0.50000000      -0.50000000       0.00000000 1.0 
      0.51016665      -0.48983335      -0.02554764 1.0 
      0.52033330      -0.47966670      -0.05109528 1.0 
      0.53049994      -0.46950006      -0.07664291 1.0 
      0.54066659      -0.45933341      -0.10219055 1.0 
      0.55083324      -0.44916676      -0.12773819 1.0 
      0.56099989      -0.43900011      -0.15328583 1.0 
      0.57116653      -0.42883347      -0.17883347 1.0 
      0.58133318      -0.41866682      -0.20438110 1.0 
      0.59149983      -0.40850017      -0.22992874 1.0 
      0.60166648      -0.39833352      -0.25547638 1.0 
      0.61183312      -0.38816688      -0.28102402 1.0 
      0.62199977      -0.37800023      -0.30657166 1.0 
      0.63216642      -0.36783358      -0.33211930 1.0 
      0.64233307      -0.35766693      -0.35766693 1.0 
      0.64233307      -0.35766693      -0.35766693 1.0 
      0.64880275      -0.35119725      -0.35119725 1.0 
      0.65527244      -0.34472756      -0.34472756 1.0 
      0.66174212      -0.33825788      -0.33825788 1.0 
      0.66821181      -0.33178819      -0.33178819 1.0 
      0.67468149      -0.32531851      -0.32531851 1.0 
      0.68115118      -0.31884882      -0.31884882 1.0 
      0.68762086      -0.31237914      -0.31237914 1.0 
      0.69409055      -0.30590945      -0.30590945 1.0 
      0.70056023      -0.29943977      -0.29943977 1.0 
      0.70702992      -0.29297008      -0.29297008 1.0 
      0.71349960      -0.28650040      -0.28650040 1.0 
      0.71996928      -0.28003072      -0.28003072 1.0 
      0.72643897      -0.27356103      -0.27356103 1.0 
      0.73290865      -0.26709135      -0.26709135 1.0 
      0.73937834      -0.26062166      -0.26062166 1.0 
      0.74584802      -0.25415198      -0.25415198 1.0 
      0.75231771      -0.24768229      -0.24768229 1.0 
      0.75878739      -0.24121261      -0.24121261 1.0 
      0.76525708      -0.23474292      -0.23474292 1.0 
      0.77172676      -0.22827324      -0.22827324 1.0 
      0.77819645      -0.22180355      -0.22180355 1.0 
      0.78466613      -0.21533387      -0.21533387 1.0 
      0.78466613      -0.21533387      -0.21533387 1.0 
      0.76687450      -0.20187550      -0.20187550 1.0 
      0.74908287      -0.18841713      -0.18841713 1.0 
      0.73129123      -0.17495877      -0.17495877 1.0 
      0.71349960      -0.16150040      -0.16150040 1.0 
      0.69570797      -0.14804203      -0.14804203 1.0 
      0.67791633      -0.13458367      -0.13458367 1.0 
      0.66012470      -0.12112530      -0.12112530 1.0 
      0.64233307      -0.10766693      -0.10766693 1.0 
      0.62454143      -0.09420857      -0.09420857 1.0 
      0.60674980      -0.08075020      -0.08075020 1.0 
      0.58895817      -0.06729183      -0.06729183 1.0 
      0.57116653      -0.05383347      -0.05383347 1.0 
      0.55337490      -0.04037510      -0.04037510 1.0 
      0.53558327      -0.02691673      -0.02691673 1.0 
      0.51779163      -0.01345837      -0.01345837 1.0 
      0.50000000      -0.00000000       0.00000000 1.0 
      0.50000000      -0.00000000       0.00000000 1.0 
      0.50000000      -0.02083333       0.02083333 1.0 
      0.50000000      -0.04166667       0.04166667 1.0 
      0.50000000      -0.06250000       0.06250000 1.0 
      0.50000000      -0.08333333       0.08333333 1.0 
      0.50000000      -0.10416667       0.10416667 1.0 
      0.50000000      -0.12500000       0.12500000 1.0 
      0.50000000      -0.14583333       0.14583333 1.0 
      0.50000000      -0.16666667       0.16666667 1.0 
      0.50000000      -0.18750000       0.18750000 1.0 
      0.50000000      -0.20833333       0.20833333 1.0 
      0.50000000      -0.22916667       0.22916667 1.0 
      0.50000000      -0.25000000       0.25000000 1.0 
      0.50000000      -0.27083333       0.27083333 1.0 
      0.50000000      -0.29166667       0.29166667 1.0 
      0.50000000      -0.31250000       0.31250000 1.0 
      0.50000000      -0.33333333       0.33333333 1.0 
      0.50000000      -0.35416667       0.35416667 1.0 
      0.50000000      -0.37500000       0.37500000 1.0 
      0.50000000      -0.39583333       0.39583333 1.0 
      0.50000000      -0.41666667       0.41666667 1.0 
      0.50000000      -0.43750000       0.43750000 1.0 
      0.50000000      -0.45833333       0.45833333 1.0 
      0.50000000      -0.47916667       0.47916667 1.0 
      0.50000000      -0.50000000       0.50000000 1.0 

