! Pwscf input file created with ciftopw.py 
! Compound: Rb6Br4O
&control
         calculation     = 'bands'
         prefix          = 'Rb6Br4O'
         restart_mode    = 'from_scratch'
         outdir          = './'
         wf_collect      = .true.
         verbosity       = 'high'
       /
&system
         ibrav           =  14
         celldm(1)       =           17.6400453345230268
         celldm(2)       =            1.0000000000000000
         celldm(3)       =            1.0000000000000000
         celldm(4)       =            0.0185889392484010
         celldm(5)       =            0.0185889392484010
         celldm(6)       =            0.0185889392484010
         nat             =       22
         ntyp            =        3
         ecutwfc         =       50.00000000
         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
 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 
Rb  85.4678 Rb.rel-pbe-spn-rrkjus_psl.1.0.0.UPF 
ATOMIC_POSITIONS crystal
K_POINTS crystal
147
      0.00000000       0.00000000       0.00000000 1.0 
      0.02941176      -0.00000000       0.00000000 1.0 
      0.05882353      -0.00000000       0.00000000 1.0 
      0.08823529      -0.00000000       0.00000000 1.0 
      0.11764706      -0.00000000       0.00000000 1.0 
      0.14705882       0.00000000      -0.00000000 1.0 
      0.17647059      -0.00000000       0.00000000 1.0 
      0.20588235      -0.00000000      -0.00000000 1.0 
      0.23529412      -0.00000000       0.00000000 1.0 
      0.26470588      -0.00000000      -0.00000000 1.0 
      0.29411765       0.00000000      -0.00000000 1.0 
      0.32352941      -0.00000000      -0.00000000 1.0 
      0.35294118      -0.00000000       0.00000000 1.0 
      0.38235294      -0.00000000      -0.00000000 1.0 
      0.41176471      -0.00000000      -0.00000000 1.0 
      0.44117647      -0.00000000       0.00000000 1.0 
      0.47058824      -0.00000000       0.00000000 1.0 
      0.50000000      -0.00000000      -0.00000000 1.0 
      0.50000000      -0.00000000      -0.00000000 1.0 
      0.50000000       0.02008656      -0.02008656 1.0 
      0.50000000       0.04017312      -0.04017312 1.0 
      0.50000000       0.06025967      -0.06025967 1.0 
      0.50000000       0.08034623      -0.08034623 1.0 
      0.50000000       0.10043279      -0.10043279 1.0 
      0.50000000       0.12051935      -0.12051935 1.0 
      0.50000000       0.14060590      -0.14060590 1.0 
      0.50000000       0.16069246      -0.16069246 1.0 
      0.50000000       0.18077902      -0.18077902 1.0 
      0.50000000       0.20086558      -0.20086558 1.0 
      0.50000000       0.22095214      -0.22095214 1.0 
      0.50000000       0.24103869      -0.24103869 1.0 
      0.50000000       0.26112525      -0.26112525 1.0 
      0.50000000       0.28121181      -0.28121181 1.0 
      0.50000000       0.30129837      -0.30129837 1.0 
      0.50000000       0.32138492      -0.32138492 1.0 
      0.50000000       0.34147148      -0.34147148 1.0 
      0.50000000       0.36155804      -0.36155804 1.0 
      0.50000000       0.38164460      -0.38164460 1.0 
      0.50000000       0.40173115      -0.40173115 1.0 
      0.50000000       0.42181771      -0.42181771 1.0 
      0.50000000       0.44190427      -0.44190427 1.0 
      0.50000000       0.46199083      -0.46199083 1.0 
      0.50000000       0.48207739      -0.48207739 1.0 
      0.51792261       0.50000000       0.48207739 1.0 
      0.50000000       0.50000000       0.50000000 1.0 
      0.50000000       0.50000000       0.50000000 1.0 
      0.48275862       0.48275862       0.48275862 1.0 
      0.46551724       0.46551724       0.46551724 1.0 
      0.44827586       0.44827586       0.44827586 1.0 
      0.43103448       0.43103448       0.43103448 1.0 
      0.41379310       0.41379310       0.41379310 1.0 
      0.39655172       0.39655172       0.39655172 1.0 
      0.37931034       0.37931034       0.37931034 1.0 
      0.36206897       0.36206897       0.36206897 1.0 
      0.34482759       0.34482759       0.34482759 1.0 
      0.32758621       0.32758621       0.32758621 1.0 
      0.31034483       0.31034483       0.31034483 1.0 
      0.29310345       0.29310345       0.29310345 1.0 
      0.27586207       0.27586207       0.27586207 1.0 
      0.25862069       0.25862069       0.25862069 1.0 
      0.24137931       0.24137931       0.24137931 1.0 
      0.22413793       0.22413793       0.22413793 1.0 
      0.20689655       0.20689655       0.20689655 1.0 
      0.18965517       0.18965517       0.18965517 1.0 
      0.17241379       0.17241379       0.17241379 1.0 
      0.15517241       0.15517241       0.15517241 1.0 
      0.13793103       0.13793103       0.13793103 1.0 
      0.12068966       0.12068966       0.12068966 1.0 
      0.10344828       0.10344828       0.10344828 1.0 
      0.08620690       0.08620690       0.08620690 1.0 
      0.06896552       0.06896552       0.06896552 1.0 
      0.05172414       0.05172414       0.05172414 1.0 
      0.03448276       0.03448276       0.03448276 1.0 
      0.01724138       0.01724138       0.01724138 1.0 
      0.00000000       0.00000000       0.00000000 1.0 
      0.00000000       0.00000000       0.00000000 1.0 
      0.02045995      -0.00000000      -0.02045995 1.0 
      0.04091989      -0.00000000      -0.04091989 1.0 
      0.06137984      -0.00000000      -0.06137984 1.0 
      0.08183978      -0.00000000      -0.08183978 1.0 
      0.10229973      -0.00000000      -0.10229973 1.0 
      0.12275967      -0.00000000      -0.12275967 1.0 
      0.14321962      -0.00000000      -0.14321962 1.0 
      0.16367956      -0.00000000      -0.16367956 1.0 
      0.18413951      -0.00000000      -0.18413951 1.0 
      0.20459946      -0.00000000      -0.20459946 1.0 
      0.22505940      -0.00000000      -0.22505940 1.0 
      0.24551935      -0.00000000      -0.24551935 1.0 
      0.26597929       0.00000000      -0.26597929 1.0 
      0.28643924      -0.00000000      -0.28643924 1.0 
      0.30689918      -0.00000000      -0.30689918 1.0 
      0.32735913      -0.00000000      -0.32735913 1.0 
      0.34781907      -0.00000000      -0.34781907 1.0 
      0.36827902      -0.00000000      -0.36827902 1.0 
      0.38873897      -0.00000000      -0.38873897 1.0 
      0.40919891      -0.00000000      -0.40919891 1.0 
      0.42965886      -0.00000000      -0.42965886 1.0 
      0.45011880      -0.00000000      -0.45011880 1.0 
      0.47057875      -0.00000000      -0.47057875 1.0 
      0.49103869      -0.00000000      -0.49103869 1.0 
      0.50896131       0.49103869       0.00000000 1.0 
      0.50000000       0.50000000       0.00000000 1.0 
      0.50000000       0.50000000       0.00000000 1.0 
      0.50052714       0.50052714       0.02835749 1.0 
      0.50105427       0.50105427       0.05671499 1.0 
      0.50158141       0.50158141       0.08507248 1.0 
      0.50210854       0.50210854       0.11342997 1.0 
      0.50263568       0.50263568       0.14178747 1.0 
      0.50316281       0.50316281       0.17014496 1.0 
      0.50368995       0.50368995       0.19850245 1.0 
      0.50421709       0.50421709       0.22685995 1.0 
      0.50474422       0.50474422       0.25521744 1.0 
      0.50527136       0.50527136       0.28357493 1.0 
      0.50579849       0.50579849       0.31193243 1.0 
      0.50632563       0.50632563       0.34028992 1.0 
      0.50685276       0.50685276       0.36864741 1.0 
      0.50737990       0.50737990       0.39700491 1.0 
      0.50790704       0.50790704       0.42536240 1.0 
      0.50843417       0.50843417       0.45371989 1.0 
      0.50896131       0.50896131       0.48207739 1.0 
      0.50896131       0.50896131       0.48207739 1.0 
      0.50000000       0.50000000       0.50000000 1.0 
      0.50000000      -0.00000000      -0.00000000 1.0 
      0.50074678       0.02045995       0.02045995 1.0 
      0.50149355       0.04091989       0.04091989 1.0 
      0.50224033       0.06137984       0.06137984 1.0 
      0.50298710       0.08183978       0.08183978 1.0 
      0.50373388       0.10229973       0.10229973 1.0 
      0.50448065       0.12275967       0.12275967 1.0 
      0.50522743       0.14321962       0.14321962 1.0 
      0.50597420       0.16367956       0.16367956 1.0 
      0.50672098       0.18413951       0.18413951 1.0 
      0.50746776       0.20459946       0.20459946 1.0 
      0.50821453       0.22505940       0.22505940 1.0 
      0.50896131       0.24551935       0.24551935 1.0 
      0.50970808       0.26597929       0.26597929 1.0 
      0.51045486       0.28643924       0.28643924 1.0 
      0.51120163       0.30689918       0.30689918 1.0 
      0.51194841       0.32735913       0.32735913 1.0 
      0.51269519       0.34781907       0.34781907 1.0 
      0.51344196       0.36827902       0.36827902 1.0 
      0.51418874       0.38873897       0.38873897 1.0 
      0.51493551       0.40919891       0.40919891 1.0 
      0.51568229       0.42965886       0.42965886 1.0 
      0.51642906       0.45011880       0.45011880 1.0 
      0.51717584       0.47057875       0.47057875 1.0 
      0.51792261       0.49103869       0.49103869 1.0 

