! Pwscf input file created with ciftopw.py 
! Compound: K3B6BrO10
&control
         calculation     = 'bands'
         prefix          = 'K3B6BrO10'
         restart_mode    = 'from_scratch'
         outdir          = './'
         wf_collect      = .true.
         verbosity       = 'high'
       /
&system
         ibrav           =  14
         celldm(1)       =           12.3668141868313182
         celldm(2)       =            1.0000000000000000
         celldm(3)       =            0.9999999999999999
         celldm(4)       =           -0.1945643241186461
         celldm(5)       =           -0.1945643241186461
         celldm(6)       =           -0.1945643241186461
         nat             =       20
         ntyp            =        4
         ecutwfc         =       50.00000000
         ecutrho         =      325.00000000
         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 
Br  79.9040 Br.rel-pbe-n-rrkjus_psl.1.0.0.UPF 
 K  39.0983 K.rel-pbe-spn-rrkjus_psl.1.0.0.UPF 
 B  10.8110 B.rel-pbe-n-rrkjus_psl.1.0.0.UPF 
ATOMIC_POSITIONS crystal
K_POINTS crystal
252
      0.00000000       0.00000000       0.00000000 1.0 
      0.01131250      -0.01571452       0.01131250 1.0 
      0.02262501      -0.03142905       0.02262501 1.0 
      0.03393751      -0.04714357       0.03393751 1.0 
      0.04525002      -0.06285809       0.04525002 1.0 
      0.05656252      -0.07857262       0.05656252 1.0 
      0.06787502      -0.09428714       0.06787502 1.0 
      0.07918753      -0.11000166       0.07918753 1.0 
      0.09050003      -0.12571619       0.09050003 1.0 
      0.10181253      -0.14143071       0.10181253 1.0 
      0.11312504      -0.15714523       0.11312504 1.0 
      0.12443754      -0.17285975       0.12443754 1.0 
      0.13575005      -0.18857428       0.13575005 1.0 
      0.14706255      -0.20428880       0.14706255 1.0 
      0.15837505      -0.22000332       0.15837505 1.0 
      0.16968756      -0.23571785       0.16968756 1.0 
      0.18100006      -0.25143237       0.18100006 1.0 
      0.19231257      -0.26714689       0.19231257 1.0 
      0.20362507      -0.28286142       0.20362507 1.0 
      0.21493757      -0.29857594       0.21493757 1.0 
      0.22625008      -0.31429046       0.22625008 1.0 
      0.23756258      -0.33000499       0.23756258 1.0 
      0.24887508      -0.34571951       0.24887508 1.0 
      0.26018759      -0.36143403       0.26018759 1.0 
      0.27150009      -0.37714856       0.27150009 1.0 
      0.28281260      -0.39286308       0.28281260 1.0 
      0.29412510      -0.40857760       0.29412510 1.0 
      0.30543760      -0.42429213       0.30543760 1.0 
      0.31675011      -0.44000665       0.31675011 1.0 
      0.32806261      -0.45572117       0.32806261 1.0 
      0.33937512      -0.47143570       0.33937512 1.0 
      0.35068762      -0.48715022       0.35068762 1.0 
      0.36200012      -0.50286474       0.36200012 1.0 
      0.37331263      -0.51857926       0.37331263 1.0 
      0.38462513      -0.53429379       0.38462513 1.0 
      0.39593763      -0.55000831       0.39593763 1.0 
      0.40725014      -0.56572283       0.40725014 1.0 
      0.41856264      -0.58143736       0.41856264 1.0 
      0.41856264      -0.58143736       0.41856264 1.0 
      0.42761124      -0.57238876       0.42761124 1.0 
      0.43665983      -0.56334017       0.43665983 1.0 
      0.44570843      -0.55429157       0.44570843 1.0 
      0.45475702      -0.54524298       0.45475702 1.0 
      0.46380562      -0.53619438       0.46380562 1.0 
      0.47285421      -0.52714579       0.47285421 1.0 
      0.48190281      -0.51809719       0.48190281 1.0 
      0.49095140      -0.50904860       0.49095140 1.0 
      0.50000000      -0.50000000       0.50000000 1.0 
      0.50000000      -0.50000000       0.50000000 1.0 
      0.49602745      -0.47958231       0.49602745 1.0 
      0.49205489      -0.45916462       0.49205489 1.0 
      0.48808234      -0.43874693       0.48808234 1.0 
      0.48410978      -0.41832924       0.48410978 1.0 
      0.48013723      -0.39791155       0.48013723 1.0 
      0.47616468      -0.37749386       0.47616468 1.0 
      0.47219212      -0.35707617       0.47219212 1.0 
      0.46821957      -0.33665848       0.46821957 1.0 
      0.46424701      -0.31624079       0.46424701 1.0 
      0.46027446      -0.29582310       0.46027446 1.0 
      0.45630191      -0.27540541       0.45630191 1.0 
      0.45232935      -0.25498772       0.45232935 1.0 
      0.44835680      -0.23457003       0.44835680 1.0 
      0.44438424      -0.21415234       0.44438424 1.0 
      0.44041169      -0.19373465       0.44041169 1.0 
      0.43643914      -0.17331696       0.43643914 1.0 
      0.43246658      -0.15289927       0.43246658 1.0 
      0.42849403      -0.13248158       0.42849403 1.0 
      0.42452147      -0.11206389       0.42452147 1.0 
      0.42054892      -0.09164620       0.42054892 1.0 
      0.41657637      -0.07122851       0.41657637 1.0 
      0.41260381      -0.05081082       0.41260381 1.0 
      0.40863126      -0.03039313       0.40863126 1.0 
      0.40465870      -0.00997544       0.40465870 1.0 
      0.40068615       0.01044225       0.40068615 1.0 
      0.39671360       0.03085994       0.39671360 1.0 
      0.39274104       0.05127763       0.39274104 1.0 
      0.38876849       0.07169532       0.38876849 1.0 
      0.38479593       0.09211301       0.38479593 1.0 
      0.38082338       0.11253070       0.38082338 1.0 
      0.37685083       0.13294839       0.37685083 1.0 
      0.37287827       0.15336608       0.37287827 1.0 
      0.36890572       0.17378377       0.36890572 1.0 
      0.36493316       0.19420146       0.36493316 1.0 
      0.36096061       0.21461915       0.36096061 1.0 
      0.35698805       0.23503684       0.35698805 1.0 
      0.35301550       0.25545453       0.35301550 1.0 
      0.34904295       0.27587222       0.34904295 1.0 
      0.34507039       0.29628991       0.34507039 1.0 
      0.34109784       0.31670759       0.34109784 1.0 
      0.33712528       0.33712528       0.33712528 1.0 
      0.33712528       0.33712528       0.33712528 1.0 
      0.32776069       0.32776069       0.32776069 1.0 
      0.31839610       0.31839610       0.31839610 1.0 
      0.30903151       0.30903151       0.30903151 1.0 
      0.29966692       0.29966692       0.29966692 1.0 
      0.29030233       0.29030233       0.29030233 1.0 
      0.28093774       0.28093774       0.28093774 1.0 
      0.27157315       0.27157315       0.27157315 1.0 
      0.26220855       0.26220855       0.26220855 1.0 
      0.25284396       0.25284396       0.25284396 1.0 
      0.24347937       0.24347937       0.24347937 1.0 
      0.23411478       0.23411478       0.23411478 1.0 
      0.22475019       0.22475019       0.22475019 1.0 
      0.21538560       0.21538560       0.21538560 1.0 
      0.20602101       0.20602101       0.20602101 1.0 
      0.19665642       0.19665642       0.19665642 1.0 
      0.18729182       0.18729182       0.18729182 1.0 
      0.17792723       0.17792723       0.17792723 1.0 
      0.16856264       0.16856264       0.16856264 1.0 
      0.15919805       0.15919805       0.15919805 1.0 
      0.14983346       0.14983346       0.14983346 1.0 
      0.14046887       0.14046887       0.14046887 1.0 
      0.13110428       0.13110428       0.13110428 1.0 
      0.12173969       0.12173969       0.12173969 1.0 
      0.11237509       0.11237509       0.11237509 1.0 
      0.10301050       0.10301050       0.10301050 1.0 
      0.09364591       0.09364591       0.09364591 1.0 
      0.08428132       0.08428132       0.08428132 1.0 
      0.07491673       0.07491673       0.07491673 1.0 
      0.06555214       0.06555214       0.06555214 1.0 
      0.05618755       0.05618755       0.05618755 1.0 
      0.04682296       0.04682296       0.04682296 1.0 
      0.03745836       0.03745836       0.03745836 1.0 
      0.02809377       0.02809377       0.02809377 1.0 
      0.01872918       0.01872918       0.01872918 1.0 
      0.00936459       0.00936459       0.00936459 1.0 
      0.00000000       0.00000000       0.00000000 1.0 
      0.00000000       0.00000000       0.00000000 1.0 
      0.01562500      -0.01562500       0.00000000 1.0 
      0.03125000      -0.03125000       0.00000000 1.0 
      0.04687500      -0.04687500       0.00000000 1.0 
      0.06250000      -0.06250000       0.00000000 1.0 
      0.07812500      -0.07812500       0.00000000 1.0 
      0.09375000      -0.09375000       0.00000000 1.0 
      0.10937500      -0.10937500       0.00000000 1.0 
      0.12500000      -0.12500000       0.00000000 1.0 
      0.14062500      -0.14062500       0.00000000 1.0 
      0.15625000      -0.15625000       0.00000000 1.0 
      0.17187500      -0.17187500       0.00000000 1.0 
      0.18750000      -0.18750000       0.00000000 1.0 
      0.20312500      -0.20312500       0.00000000 1.0 
      0.21875000      -0.21875000       0.00000000 1.0 
      0.23437500      -0.23437500       0.00000000 1.0 
      0.25000000      -0.25000000       0.00000000 1.0 
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      0.28125000      -0.28125000       0.00000000 1.0 
      0.29687500      -0.29687500       0.00000000 1.0 
      0.31250000      -0.31250000       0.00000000 1.0 
      0.32812500      -0.32812500       0.00000000 1.0 
      0.34375000      -0.34375000       0.00000000 1.0 
      0.35937500      -0.35937500       0.00000000 1.0 
      0.37500000      -0.37500000       0.00000000 1.0 
      0.39062500      -0.39062500       0.00000000 1.0 
      0.40625000      -0.40625000       0.00000000 1.0 
      0.42187500      -0.42187500       0.00000000 1.0 
      0.43750000      -0.43750000       0.00000000 1.0 
      0.45312500      -0.45312500       0.00000000 1.0 
      0.46875000      -0.46875000       0.00000000 1.0 
      0.48437500      -0.48437500       0.00000000 1.0 
      0.50000000      -0.50000000       0.00000000 1.0 
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      0.50387797      -0.49612203      -0.01993155 1.0 
      0.50775594      -0.49224406      -0.03986311 1.0 
      0.51163391      -0.48836609      -0.05979466 1.0 
      0.51551188      -0.48448812      -0.07972622 1.0 
      0.51938985      -0.48061015      -0.09965777 1.0 
      0.52326782      -0.47673218      -0.11958933 1.0 
      0.52714579      -0.47285421      -0.13952088 1.0 
      0.53102376      -0.46897624      -0.15945244 1.0 
      0.53490172      -0.46509828      -0.17938399 1.0 
      0.53877969      -0.46122031      -0.19931554 1.0 
      0.54265766      -0.45734234      -0.21924710 1.0 
      0.54653563      -0.45346437      -0.23917865 1.0 
      0.55041360      -0.44958640      -0.25911021 1.0 
      0.55429157      -0.44570843      -0.27904176 1.0 
      0.55816954      -0.44183046      -0.29897332 1.0 
      0.56204751      -0.43795249      -0.31890487 1.0 
      0.56592548      -0.43407452      -0.33883642 1.0 
      0.56980345      -0.43019655      -0.35876798 1.0 
      0.57368142      -0.42631858      -0.37869953 1.0 
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      0.58143736      -0.41856264      -0.41856264 1.0 
      0.58143736      -0.41856264      -0.41856264 1.0 
      0.59048595      -0.40951405      -0.40951405 1.0 
      0.59953455      -0.40046545      -0.40046545 1.0 
      0.60858314      -0.39141686      -0.39141686 1.0 
      0.61763174      -0.38236826      -0.38236826 1.0 
      0.62668033      -0.37331967      -0.37331967 1.0 
      0.63572893      -0.36427107      -0.36427107 1.0 
      0.64477752      -0.35522248      -0.35522248 1.0 
      0.65382612      -0.34617388      -0.34617388 1.0 
      0.66287472      -0.33712528      -0.33712528 1.0 
      0.66287472      -0.33712528      -0.33712528 1.0 
      0.65661030      -0.32415893      -0.32415893 1.0 
      0.65034589      -0.31119257      -0.31119257 1.0 
      0.64408148      -0.29822621      -0.29822621 1.0 
      0.63781707      -0.28525986      -0.28525986 1.0 
      0.63155265      -0.27229350      -0.27229350 1.0 
      0.62528824      -0.25932714      -0.25932714 1.0 
      0.61902383      -0.24636079      -0.24636079 1.0 
      0.61275942      -0.23339443      -0.23339443 1.0 
      0.60649501      -0.22042807      -0.22042807 1.0 
      0.60023059      -0.20746171      -0.20746171 1.0 
      0.59396618      -0.19449536      -0.19449536 1.0 
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      0.53132206      -0.06483179      -0.06483179 1.0 
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      0.51252882      -0.02593271      -0.02593271 1.0 
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      0.50000000      -0.00000000       0.00000000 1.0 
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      0.50000000      -0.03125000       0.03125000 1.0 
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      0.50000000      -0.48437500       0.48437500 1.0 
      0.50000000      -0.50000000       0.50000000 1.0 

