! Pwscf input file created with ciftopw.py 
! Compound: Cs2NaAl3F12
&control
         calculation     = 'bands'
         prefix          = 'Cs2NaAl3F12'
         restart_mode    = 'from_scratch'
         outdir          = './'
         wf_collect      = .true.
         verbosity       = 'high'
       /
&system
         ibrav           =  14
         celldm(1)       =           13.8138969795899982
         celldm(2)       =            1.0000000000000000
         celldm(3)       =            1.0000000000000000
         celldm(4)       =            0.5380354015455252
         celldm(5)       =            0.5380354015455252
         celldm(6)       =            0.5380354015455253
         nat             =       18
         ntyp            =        4
         ecutwfc         =       80.00000000
         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
 F  18.9984 F.rel-pbe-n-rrkjus_psl.1.0.0.UPF 
Na  22.9898 Na.rel-pbe-spnl-rrkjus_psl.1.0.0.UPF 
Al  26.9815 Al.rel-pbe-n-rrkjus_psl.1.0.0.UPF 
Cs 132.9055 Cs.rel-pbe-oncvpsp.UPF 
ATOMIC_POSITIONS crystal
K_POINTS crystal
206
      0.00000000       0.00000000       0.00000000 1.0 
      0.01785714      -0.00000000      -0.00000000 1.0 
      0.03571429      -0.00000000      -0.00000000 1.0 
      0.05357143      -0.00000000       0.00000000 1.0 
      0.07142857      -0.00000000      -0.00000000 1.0 
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      0.12500000       0.00000000       0.00000000 1.0 
      0.14285714      -0.00000000      -0.00000000 1.0 
      0.16071429      -0.00000000      -0.00000000 1.0 
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      0.37500000      -0.00000000       0.00000000 1.0 
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      0.41071429      -0.00000000      -0.00000000 1.0 
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      0.44642857      -0.00000000       0.00000000 1.0 
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      0.50000000       0.00000000       0.00000000 1.0 
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      0.50000000       0.02189451      -0.02189451 1.0 
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      0.50000000       0.04378901      -0.04378901 1.0 
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      0.50000000       0.10947253      -0.10947253 1.0 
      0.50000000       0.12041979      -0.12041979 1.0 
      0.50000000       0.13136704      -0.13136704 1.0 
      0.50000000       0.14231429      -0.14231429 1.0 
      0.50000000       0.15326154      -0.15326154 1.0 
      0.50000000       0.16420880      -0.16420880 1.0 
      0.50000000       0.17515605      -0.17515605 1.0 
      0.50000000       0.18610330      -0.18610330 1.0 
      0.50000000       0.19705056      -0.19705056 1.0 
      0.50000000       0.20799781      -0.20799781 1.0 
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      0.75916043       0.50000000       0.24083957 1.0 
      0.74836208       0.50000000       0.25163792 1.0 
      0.73756373       0.50000000       0.26243627 1.0 
      0.72676538       0.50000000       0.27323462 1.0 
      0.71596702       0.50000000       0.28403298 1.0 
      0.70516867       0.50000000       0.29483133 1.0 
      0.69437032       0.50000000       0.30562968 1.0 
      0.68357197       0.50000000       0.31642803 1.0 
      0.67277362       0.50000000       0.32722638 1.0 
      0.66197527       0.50000000       0.33802473 1.0 
      0.65117692       0.50000000       0.34882308 1.0 
      0.64037857       0.50000000       0.35962143 1.0 
      0.62958021       0.50000000       0.37041979 1.0 
      0.61878186       0.50000000       0.38121814 1.0 
      0.60798351       0.50000000       0.39201649 1.0 
      0.59718516       0.50000000       0.40281484 1.0 
      0.58638681       0.50000000       0.41361319 1.0 
      0.57558846       0.50000000       0.42441154 1.0 
      0.56479011       0.50000000       0.43520989 1.0 
      0.55399176       0.50000000       0.44600824 1.0 
      0.54319340       0.50000000       0.45680660 1.0 
      0.53239505       0.50000000       0.46760495 1.0 
      0.52159670       0.50000000       0.47840330 1.0 
      0.51079835       0.50000000       0.48920165 1.0 
      0.50000000       0.50000000       0.50000000 1.0 
      0.50000000       0.50000000       0.50000000 1.0 
      0.48076923       0.48076923       0.48076923 1.0 
      0.46153846       0.46153846       0.46153846 1.0 
      0.44230769       0.44230769       0.44230769 1.0 
      0.42307692       0.42307692       0.42307692 1.0 
      0.40384615       0.40384615       0.40384615 1.0 
      0.38461538       0.38461538       0.38461538 1.0 
      0.36538462       0.36538462       0.36538462 1.0 
      0.34615385       0.34615385       0.34615385 1.0 
      0.32692308       0.32692308       0.32692308 1.0 
      0.30769231       0.30769231       0.30769231 1.0 
      0.28846154       0.28846154       0.28846154 1.0 
      0.26923077       0.26923077       0.26923077 1.0 
      0.25000000       0.25000000       0.25000000 1.0 
      0.23076923       0.23076923       0.23076923 1.0 
      0.21153846       0.21153846       0.21153846 1.0 
      0.19230769       0.19230769       0.19230769 1.0 
      0.17307692       0.17307692       0.17307692 1.0 
      0.15384615       0.15384615       0.15384615 1.0 
      0.13461538       0.13461538       0.13461538 1.0 
      0.11538462       0.11538462       0.11538462 1.0 
      0.09615385       0.09615385       0.09615385 1.0 
      0.07692308       0.07692308       0.07692308 1.0 
      0.05769231       0.05769231       0.05769231 1.0 
      0.03846154       0.03846154       0.03846154 1.0 
      0.01923077       0.01923077       0.01923077 1.0 
      0.00000000       0.00000000       0.00000000 1.0 
      0.00000000       0.00000000       0.00000000 1.0 
      0.01089470      -0.00000000      -0.01089470 1.0 
      0.02178940      -0.00000000      -0.02178940 1.0 
      0.03268410       0.00000000      -0.03268410 1.0 
      0.04357880      -0.00000000      -0.04357880 1.0 
      0.05447350       0.00000000      -0.05447350 1.0 
      0.06536820       0.00000000      -0.06536820 1.0 
      0.07626290       0.00000000      -0.07626290 1.0 
      0.08715760      -0.00000000      -0.08715760 1.0 
      0.09805230       0.00000000      -0.09805230 1.0 
      0.10894700       0.00000000      -0.10894700 1.0 
      0.11984170       0.00000000      -0.11984170 1.0 
      0.13073639       0.00000000      -0.13073639 1.0 
      0.14163109       0.00000000      -0.14163109 1.0 
      0.15252579       0.00000000      -0.15252579 1.0 
      0.16342049       0.00000000      -0.16342049 1.0 
      0.17431519      -0.00000000      -0.17431519 1.0 
      0.18520989       0.00000000      -0.18520989 1.0 
      0.19610459       0.00000000      -0.19610459 1.0 
      0.20699929       0.00000000      -0.20699929 1.0 
      0.21789399       0.00000000      -0.21789399 1.0 
      0.22878869      -0.00000000      -0.22878869 1.0 
      0.23968339       0.00000000      -0.23968339 1.0 
      0.25057809       0.00000000      -0.25057809 1.0 
      0.26147279       0.00000000      -0.26147279 1.0 
      0.27236749       0.00000000      -0.27236749 1.0 
      0.28326219       0.00000000      -0.28326219 1.0 
      0.29415689      -0.00000000      -0.29415689 1.0 
      0.30505159       0.00000000      -0.30505159 1.0 
      0.31594629      -0.00000000      -0.31594629 1.0 
      0.32684099       0.00000000      -0.32684099 1.0 
      0.33773569      -0.00000000      -0.33773569 1.0 
      0.34863039      -0.00000000      -0.34863039 1.0 
      0.35952509      -0.00000000      -0.35952509 1.0 
      0.37041979       0.00000000      -0.37041979 1.0 
      0.62958021       0.37041979       0.00000000 1.0 
      0.61878186       0.38121814       0.00000000 1.0 
      0.60798351       0.39201649       0.00000000 1.0 
      0.59718516       0.40281484       0.00000000 1.0 
      0.58638681       0.41361319       0.00000000 1.0 
      0.57558846       0.42441154       0.00000000 1.0 
      0.56479011       0.43520989       0.00000000 1.0 
      0.55399176       0.44600824       0.00000000 1.0 
      0.54319340       0.45680660       0.00000000 1.0 
      0.53239505       0.46760495       0.00000000 1.0 
      0.52159670       0.47840330       0.00000000 1.0 
      0.51079835       0.48920165       0.00000000 1.0 
      0.50000000       0.50000000       0.00000000 1.0 
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      0.51178002       0.51178002       0.02189451 1.0 
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      0.54712008       0.54712008       0.08757803 1.0 
      0.55890010       0.55890010       0.10947253 1.0 
      0.57068012       0.57068012       0.13136704 1.0 
      0.58246014       0.58246014       0.15326154 1.0 
      0.59424016       0.59424016       0.17515605 1.0 
      0.60602018       0.60602018       0.19705056 1.0 
      0.61780020       0.61780020       0.21894506 1.0 
      0.62958021       0.62958021       0.24083957 1.0 
      0.62958021       0.62958021       0.24083957 1.0 
      0.62340973       0.62340973       0.25318054 1.0 
      0.61723924       0.61723924       0.26552152 1.0 
      0.61106876       0.61106876       0.27786249 1.0 
      0.60489827       0.60489827       0.29020346 1.0 
      0.59872778       0.59872778       0.30254443 1.0 
      0.59255730       0.59255730       0.31488541 1.0 
      0.58638681       0.58638681       0.32722638 1.0 
      0.58021632       0.58021632       0.33956735 1.0 
      0.57404584       0.57404584       0.35190833 1.0 
      0.56787535       0.56787535       0.36424930 1.0 
      0.56170486       0.56170486       0.37659027 1.0 
      0.55553438       0.55553438       0.38893124 1.0 
      0.54936389       0.54936389       0.40127222 1.0 
      0.54319340       0.54319340       0.41361319 1.0 
      0.53702292       0.53702292       0.42595416 1.0 
      0.53085243       0.53085243       0.43829514 1.0 
      0.52468195       0.52468195       0.45063611 1.0 
      0.51851146       0.51851146       0.46297708 1.0 
      0.51234097       0.51234097       0.47531805 1.0 
      0.50617049       0.50617049       0.48765903 1.0 
      0.50000000       0.50000000       0.50000000 1.0 
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      0.51364002       0.01949578       0.01949578 1.0 
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      0.54092007       0.05848733       0.05848733 1.0 
      0.55456009       0.07798311       0.07798311 1.0 
      0.56820011       0.09747889       0.09747889 1.0 
      0.58184014       0.11697467       0.11697467 1.0 
      0.59548016       0.13647045       0.13647045 1.0 
      0.60912018       0.15596623       0.15596623 1.0 
      0.62276020       0.17546200       0.17546200 1.0 
      0.63640023       0.19495778       0.19495778 1.0 
      0.65004025       0.21445356       0.21445356 1.0 
      0.66368027       0.23394934       0.23394934 1.0 
      0.67732029       0.25344512       0.25344512 1.0 
      0.69096032       0.27294089       0.27294089 1.0 
      0.70460034       0.29243667       0.29243667 1.0 
      0.71824036       0.31193245       0.31193245 1.0 
      0.73188038       0.33142823       0.33142823 1.0 
      0.74552041       0.35092401       0.35092401 1.0 
      0.75916043       0.37041979       0.37041979 1.0 

