! Pwscf input file created with ciftopw.py 
! Compound: CsBrF4
&control
         calculation     = 'bands'
         prefix          = 'CsBrF4'
         restart_mode    = 'from_scratch'
         outdir          = './'
         wf_collect      = .true.
         verbosity       = 'high'
       /
&system
         ibrav           =  14
         celldm(1)       =           14.2987012873307755
         celldm(2)       =            1.0000000000000000
         celldm(3)       =            1.0000000000000000
         celldm(4)       =           -0.7220716297625951
         celldm(5)       =           -0.5924616429875755
         celldm(6)       =            0.3145332727501706
         nat             =       12
         ntyp            =        3
         ecutwfc         =       80.00000000
         ecutrho         =      320.00000000
         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 
Br  79.9040 Br.rel-pbe-n-rrkjus_psl.1.0.0.UPF 
Cs 132.9055 Cs.rel-pbe-oncvpsp.UPF 
ATOMIC_POSITIONS crystal
K_POINTS crystal
284
      0.00000000       0.00000000       0.00000000 1.0 
     -0.00890755       0.00890755       0.00890755 1.0 
     -0.01781511       0.01781511       0.01781511 1.0 
     -0.02672266       0.02672266       0.02672266 1.0 
     -0.03563022       0.03563022       0.03563022 1.0 
     -0.04453777       0.04453777       0.04453777 1.0 
     -0.05344533       0.05344533       0.05344533 1.0 
     -0.06235288       0.06235288       0.06235288 1.0 
     -0.07126044       0.07126044       0.07126044 1.0 
     -0.08016799       0.08016799       0.08016799 1.0 
     -0.08907555       0.08907555       0.08907555 1.0 
     -0.09798310       0.09798310       0.09798310 1.0 
     -0.10689065       0.10689065       0.10689065 1.0 
     -0.11579821       0.11579821       0.11579821 1.0 
     -0.12470576       0.12470576       0.12470576 1.0 
     -0.13361332       0.13361332       0.13361332 1.0 
     -0.14252087       0.14252087       0.14252087 1.0 
     -0.15142843       0.15142843       0.15142843 1.0 
     -0.16033598       0.16033598       0.16033598 1.0 
     -0.16924354       0.16924354       0.16924354 1.0 
     -0.17815109       0.17815109       0.17815109 1.0 
     -0.18705864       0.18705864       0.18705864 1.0 
     -0.19596620       0.19596620       0.19596620 1.0 
     -0.20487375       0.20487375       0.20487375 1.0 
     -0.21378131       0.21378131       0.21378131 1.0 
     -0.22268886       0.22268886       0.22268886 1.0 
     -0.23159642       0.23159642       0.23159642 1.0 
     -0.24050397       0.24050397       0.24050397 1.0 
     -0.24941153       0.24941153       0.24941153 1.0 
     -0.25831908       0.25831908       0.25831908 1.0 
     -0.26722664       0.26722664       0.26722664 1.0 
     -0.27613419       0.27613419       0.27613419 1.0 
     -0.28504174       0.28504174       0.28504174 1.0 
     -0.29394930       0.29394930       0.29394930 1.0 
     -0.30285685       0.30285685       0.30285685 1.0 
     -0.30285685       0.30285685       0.30285685 1.0 
     -0.29207600       0.29207600       0.31363771 1.0 
     -0.28129514       0.28129514       0.32441857 1.0 
     -0.27051428       0.27051428       0.33519943 1.0 
     -0.25973342       0.25973342       0.34598028 1.0 
     -0.24895257       0.24895257       0.35676114 1.0 
     -0.23817171       0.23817171       0.36754200 1.0 
     -0.22739085       0.22739085       0.37832285 1.0 
     -0.21661000       0.21661000       0.38910371 1.0 
     -0.20582914       0.20582914       0.39988457 1.0 
     -0.19504828       0.19504828       0.41066543 1.0 
     -0.18426742       0.18426742       0.42144628 1.0 
     -0.17348657       0.17348657       0.43222714 1.0 
     -0.16270571       0.16270571       0.44300800 1.0 
     -0.15192485       0.15192485       0.45378885 1.0 
     -0.14114399       0.14114399       0.46456971 1.0 
     -0.13036314       0.13036314       0.47535057 1.0 
     -0.13036314       0.13036314       0.47535057 1.0 
     -0.11732682       0.11732682       0.47781551 1.0 
     -0.10429051       0.10429051       0.48028046 1.0 
     -0.09125420       0.09125420       0.48274540 1.0 
     -0.07821788       0.07821788       0.48521034 1.0 
     -0.06518157       0.06518157       0.48767528 1.0 
     -0.05214526       0.05214526       0.49014023 1.0 
     -0.03910894       0.03910894       0.49260517 1.0 
     -0.02607263       0.02607263       0.49507011 1.0 
     -0.01303631       0.01303631       0.49753506 1.0 
      0.00000000       0.00000000       0.50000000 1.0 
      0.00000000       0.00000000       0.50000000 1.0 
      0.01923077       0.01923077       0.48076923 1.0 
      0.03846154       0.03846154       0.46153846 1.0 
      0.05769231       0.05769231       0.44230769 1.0 
      0.07692308       0.07692308       0.42307692 1.0 
      0.09615385       0.09615385       0.40384615 1.0 
      0.11538462       0.11538462       0.38461538 1.0 
      0.13461538       0.13461538       0.36538462 1.0 
      0.15384615       0.15384615       0.34615385 1.0 
      0.17307692       0.17307692       0.32692308 1.0 
      0.19230769       0.19230769       0.30769231 1.0 
      0.21153846       0.21153846       0.28846154 1.0 
      0.23076923       0.23076923       0.26923077 1.0 
      0.25000000       0.25000000       0.25000000 1.0 
      0.25000000       0.25000000       0.25000000 1.0 
      0.23913043       0.26086957       0.23913043 1.0 
      0.22826087       0.27173913       0.22826087 1.0 
      0.21739130       0.28260870       0.21739130 1.0 
      0.20652174       0.29347826       0.20652174 1.0 
      0.19565217       0.30434783       0.19565217 1.0 
      0.18478261       0.31521739       0.18478261 1.0 
      0.17391304       0.32608696       0.17391304 1.0 
      0.16304348       0.33695652       0.16304348 1.0 
      0.15217391       0.34782609       0.15217391 1.0 
      0.14130435       0.35869565       0.14130435 1.0 
      0.13043478       0.36956522       0.13043478 1.0 
      0.11956522       0.38043478       0.11956522 1.0 
      0.10869565       0.39130435       0.10869565 1.0 
      0.09782609       0.40217391       0.09782609 1.0 
      0.08695652       0.41304348       0.08695652 1.0 
      0.07608696       0.42391304       0.07608696 1.0 
      0.06521739       0.43478261       0.06521739 1.0 
      0.05434783       0.44565217       0.05434783 1.0 
      0.04347826       0.45652174       0.04347826 1.0 
      0.03260870       0.46739130       0.03260870 1.0 
      0.02173913       0.47826087       0.02173913 1.0 
      0.01086957       0.48913043       0.01086957 1.0 
      0.00000000       0.50000000       0.00000000 1.0 
      0.00000000       0.50000000       0.00000000 1.0 
      0.02019046       0.51314288      -0.02019046 1.0 
      0.04038091       0.52628575      -0.04038091 1.0 
      0.06057137       0.53942863      -0.06057137 1.0 
      0.08076183       0.55257151      -0.08076183 1.0 
      0.10095228       0.56571438      -0.10095228 1.0 
      0.12114274       0.57885726      -0.12114274 1.0 
      0.14133320       0.59200014      -0.14133320 1.0 
      0.16152366       0.60514301      -0.16152366 1.0 
      0.18171411       0.61828589      -0.18171411 1.0 
      0.20190457       0.63142876      -0.20190457 1.0 
      0.22209503       0.64457164      -0.22209503 1.0 
      0.24228548       0.65771452      -0.24228548 1.0 
      0.26247594       0.67085739      -0.26247594 1.0 
      0.28266640       0.68400027      -0.28266640 1.0 
      0.30285685       0.69714315      -0.30285685 1.0 
      0.30285685       0.69714315      -0.30285685 1.0 
      0.31181791       0.68818209      -0.31181791 1.0 
      0.32077896       0.67922104      -0.32077896 1.0 
      0.32974001       0.67025999      -0.32974001 1.0 
      0.33870106       0.66129894      -0.33870106 1.0 
      0.34766211       0.65233789      -0.34766211 1.0 
      0.35662317       0.64337683      -0.35662317 1.0 
      0.36558422       0.63441578      -0.36558422 1.0 
      0.37454527       0.62545473      -0.37454527 1.0 
      0.38350632       0.61649368      -0.38350632 1.0 
      0.39246737       0.60753263      -0.39246737 1.0 
      0.40142843       0.59857157      -0.40142843 1.0 
      0.41038948       0.58961052      -0.41038948 1.0 
      0.41935053       0.58064947      -0.41935053 1.0 
      0.42831158       0.57168842      -0.42831158 1.0 
      0.43727264       0.56272736      -0.43727264 1.0 
      0.44623369       0.55376631      -0.44623369 1.0 
      0.45519474       0.54480526      -0.45519474 1.0 
      0.46415579       0.53584421      -0.46415579 1.0 
      0.47311684       0.52688316      -0.47311684 1.0 
      0.48207790       0.51792210      -0.48207790 1.0 
      0.49103895       0.50896105      -0.49103895 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 
      0.01056472      -0.01056472       0.01056472 1.0 
      0.02112944      -0.02112944       0.02112944 1.0 
      0.03169416      -0.03169416       0.03169416 1.0 
      0.04225888      -0.04225888       0.04225888 1.0 
      0.05282359      -0.05282359       0.05282359 1.0 
      0.06338831      -0.06338831       0.06338831 1.0 
      0.07395303      -0.07395303       0.07395303 1.0 
      0.08451775      -0.08451775       0.08451775 1.0 
      0.09508247      -0.09508247       0.09508247 1.0 
      0.10564719      -0.10564719       0.10564719 1.0 
      0.11621191      -0.11621191       0.11621191 1.0 
      0.12677663      -0.12677663       0.12677663 1.0 
      0.13734134      -0.13734134       0.13734134 1.0 
      0.14790606      -0.14790606       0.14790606 1.0 
      0.15847078      -0.15847078       0.15847078 1.0 
      0.16903550      -0.16903550       0.16903550 1.0 
      0.17960022      -0.17960022       0.17960022 1.0 
      0.19016494      -0.19016494       0.19016494 1.0 
      0.20072966      -0.20072966       0.20072966 1.0 
      0.21129438      -0.21129438       0.21129438 1.0 
      0.22185910      -0.22185910       0.22185910 1.0 
      0.23242381      -0.23242381       0.23242381 1.0 
      0.24298853      -0.24298853       0.24298853 1.0 
      0.25355325      -0.25355325       0.25355325 1.0 
      0.26411797      -0.26411797       0.26411797 1.0 
      0.27468269      -0.27468269       0.27468269 1.0 
      0.28524741      -0.28524741       0.28524741 1.0 
      0.29581213      -0.29581213       0.29581213 1.0 
      0.30637685      -0.30637685       0.30637685 1.0 
      0.31694157      -0.31694157       0.31694157 1.0 
      0.32750628      -0.32750628       0.32750628 1.0 
      0.32750628      -0.32750628       0.32750628 1.0 
      0.33900587      -0.30567253       0.30567253 1.0 
      0.35050545      -0.28383878       0.28383878 1.0 
      0.36200503      -0.26200503       0.26200503 1.0 
      0.37350461      -0.24017127       0.24017127 1.0 
      0.38500419      -0.21833752       0.21833752 1.0 
      0.39650377      -0.19650377       0.19650377 1.0 
      0.40800335      -0.17467002       0.17467002 1.0 
      0.41950293      -0.15283627       0.15283627 1.0 
      0.43100251      -0.13100251       0.13100251 1.0 
      0.44250209      -0.10916876       0.10916876 1.0 
      0.45400168      -0.08733501       0.08733501 1.0 
      0.46550126      -0.06550126       0.06550126 1.0 
      0.47700084      -0.04366750       0.04366750 1.0 
      0.48850042      -0.02183375       0.02183375 1.0 
      0.50000000       0.00000000       0.00000000 1.0 
      0.50000000       0.00000000       0.00000000 1.0 
      0.49107143       0.00892857       0.00892857 1.0 
      0.48214286       0.01785714       0.01785714 1.0 
      0.47321429       0.02678571       0.02678571 1.0 
      0.46428571       0.03571429       0.03571429 1.0 
      0.45535714       0.04464286       0.04464286 1.0 
      0.44642857       0.05357143       0.05357143 1.0 
      0.43750000       0.06250000       0.06250000 1.0 
      0.42857143       0.07142857       0.07142857 1.0 
      0.41964286       0.08035714       0.08035714 1.0 
      0.41071429       0.08928571       0.08928571 1.0 
      0.40178571       0.09821429       0.09821429 1.0 
      0.39285714       0.10714286       0.10714286 1.0 
      0.38392857       0.11607143       0.11607143 1.0 
      0.37500000       0.12500000       0.12500000 1.0 
      0.36607143       0.13392857       0.13392857 1.0 
      0.35714286       0.14285714       0.14285714 1.0 
      0.34821429       0.15178571       0.15178571 1.0 
      0.33928571       0.16071429       0.16071429 1.0 
      0.33035714       0.16964286       0.16964286 1.0 
      0.32142857       0.17857143       0.17857143 1.0 
      0.31250000       0.18750000       0.18750000 1.0 
      0.30357143       0.19642857       0.19642857 1.0 
      0.29464286       0.20535714       0.20535714 1.0 
      0.28571429       0.21428571       0.21428571 1.0 
      0.27678571       0.22321429       0.22321429 1.0 
      0.26785714       0.23214286       0.23214286 1.0 
      0.25892857       0.24107143       0.24107143 1.0 
      0.25000000       0.25000000       0.25000000 1.0 
      0.13036314      -0.13036314       0.52464943 1.0 
      0.13932419      -0.13932419       0.51568838 1.0 
      0.14828524      -0.14828524       0.50672733 1.0 
      0.15724629      -0.15724629       0.49776627 1.0 
      0.16620735      -0.16620735       0.48880522 1.0 
      0.17516840      -0.17516840       0.47984417 1.0 
      0.18412945      -0.18412945       0.47088312 1.0 
      0.19309050      -0.19309050       0.46192207 1.0 
      0.20205155      -0.20205155       0.45296101 1.0 
      0.21101261      -0.21101261       0.44399996 1.0 
      0.21997366      -0.21997366       0.43503891 1.0 
      0.22893471      -0.22893471       0.42607786 1.0 
      0.23789576      -0.23789576       0.41711681 1.0 
      0.24685682      -0.24685682       0.40815575 1.0 
      0.25581787      -0.25581787       0.39919470 1.0 
      0.26477892      -0.26477892       0.39023365 1.0 
      0.27373997      -0.27373997       0.38127260 1.0 
      0.28270102      -0.28270102       0.37231154 1.0 
      0.29166208      -0.29166208       0.36335049 1.0 
      0.30062313      -0.30062313       0.35438944 1.0 
      0.30958418      -0.30958418       0.34542839 1.0 
      0.31854523      -0.31854523       0.33646734 1.0 
      0.32750628      -0.32750628       0.32750628 1.0 
      0.67249372       0.32750628      -0.32750628 1.0 
      0.66171286       0.33828714      -0.33828714 1.0 
      0.65093200       0.34906800      -0.34906800 1.0 
      0.64015114       0.35984886      -0.35984886 1.0 
      0.62937029       0.37062971      -0.37062971 1.0 
      0.61858943       0.38141057      -0.38141057 1.0 
      0.60780857       0.39219143      -0.39219143 1.0 
      0.59702772       0.40297228      -0.40297228 1.0 
      0.58624686       0.41375314      -0.41375314 1.0 
      0.57546600       0.42453400      -0.42453400 1.0 
      0.56468514       0.43531486      -0.43531486 1.0 
      0.55390429       0.44609571      -0.44609571 1.0 
      0.54312343       0.45687657      -0.45687657 1.0 
      0.53234257       0.46765743      -0.46765743 1.0 
      0.52156171       0.47843829      -0.47843829 1.0 
      0.51078086       0.48921914      -0.48921914 1.0 
      0.50000000       0.50000000      -0.50000000 1.0 

