! Pwscf input file created with ciftopw.py 
! Compound: Sr5Pb3F
&control
         calculation     = 'bands'
         prefix          = 'Sr5Pb3F'
         restart_mode    = 'from_scratch'
         outdir          = './'
         wf_collect      = .true.
         verbosity       = 'high'
       /
&system
         ibrav           =  14
         celldm(1)       =           19.0131872903518584
         celldm(2)       =            1.0000000000000000
         celldm(3)       =            1.0000000000000000
         celldm(4)       =           -0.6289045682361035
         celldm(5)       =           -0.6289045682361035
         celldm(6)       =            0.2578091364722073
         nat             =       18
         ntyp            =        3
         ecutwfc         =       50.00000000
         ecutrho         =      317.00000000
         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 
Pb 207.2000 Pb.rel-pbe-dn-rrkjus_psl.1.0.0.UPF 
Sr  87.6200 Sr.rel-pbe-spn-rrkjus_psl.1.0.0.UPF 
ATOMIC_POSITIONS crystal
K_POINTS crystal
188
      0.00000000       0.00000000       0.00000000 1.0 
      0.00000000       0.00000000       0.01923077 1.0 
      0.00000000       0.00000000       0.03846154 1.0 
      0.00000000       0.00000000       0.05769231 1.0 
      0.00000000       0.00000000       0.07692308 1.0 
      0.00000000       0.00000000       0.09615385 1.0 
      0.00000000       0.00000000       0.11538462 1.0 
      0.00000000       0.00000000       0.13461538 1.0 
      0.00000000       0.00000000       0.15384615 1.0 
      0.00000000       0.00000000       0.17307692 1.0 
      0.00000000       0.00000000       0.19230769 1.0 
      0.00000000       0.00000000       0.21153846 1.0 
      0.00000000       0.00000000       0.23076923 1.0 
      0.00000000       0.00000000       0.25000000 1.0 
      0.00000000       0.00000000       0.26923077 1.0 
      0.00000000       0.00000000       0.28846154 1.0 
      0.00000000       0.00000000       0.30769231 1.0 
      0.00000000       0.00000000       0.32692308 1.0 
      0.00000000       0.00000000       0.34615385 1.0 
      0.00000000       0.00000000       0.36538462 1.0 
      0.00000000       0.00000000       0.38461538 1.0 
      0.00000000       0.00000000       0.40384615 1.0 
      0.00000000       0.00000000       0.42307692 1.0 
      0.00000000       0.00000000       0.44230769 1.0 
      0.00000000       0.00000000       0.46153846 1.0 
      0.00000000       0.00000000       0.48076923 1.0 
      0.00000000       0.00000000       0.50000000 1.0 
      0.00000000       0.00000000       0.50000000 1.0 
     -0.01843957       0.01843957       0.50000000 1.0 
     -0.03687915       0.03687915       0.50000000 1.0 
     -0.05531872       0.05531872       0.50000000 1.0 
     -0.07375830       0.07375830       0.50000000 1.0 
     -0.09219787       0.09219787       0.50000000 1.0 
     -0.11063744       0.11063744       0.50000000 1.0 
     -0.12907702       0.12907702       0.50000000 1.0 
     -0.14751659       0.14751659       0.50000000 1.0 
     -0.14751659       0.14751659       0.50000000 1.0 
     -0.16107365       0.16107365       0.48644295 1.0 
     -0.17463070       0.17463070       0.47288589 1.0 
     -0.18818775       0.18818775       0.45932884 1.0 
     -0.20174481       0.20174481       0.44577178 1.0 
     -0.21530186       0.21530186       0.43221473 1.0 
     -0.22885892       0.22885892       0.41865767 1.0 
     -0.24241597       0.24241597       0.40510062 1.0 
     -0.25597302       0.25597302       0.39154357 1.0 
     -0.26953008       0.26953008       0.37798651 1.0 
     -0.28308713       0.28308713       0.36442946 1.0 
     -0.29664419       0.29664419       0.35087240 1.0 
     -0.31020124       0.31020124       0.33731535 1.0 
     -0.32375830       0.32375830       0.32375830 1.0 
     -0.32375830       0.32375830       0.32375830 1.0 
     -0.31026837       0.31026837       0.31026837 1.0 
     -0.29677844       0.29677844       0.29677844 1.0 
     -0.28328851       0.28328851       0.28328851 1.0 
     -0.26979858       0.26979858       0.26979858 1.0 
     -0.25630865       0.25630865       0.25630865 1.0 
     -0.24281872       0.24281872       0.24281872 1.0 
     -0.22932879       0.22932879       0.22932879 1.0 
     -0.21583886       0.21583886       0.21583886 1.0 
     -0.20234893       0.20234893       0.20234893 1.0 
     -0.18885901       0.18885901       0.18885901 1.0 
     -0.17536908       0.17536908       0.17536908 1.0 
     -0.16187915       0.16187915       0.16187915 1.0 
     -0.14838922       0.14838922       0.14838922 1.0 
     -0.13489929       0.13489929       0.13489929 1.0 
     -0.12140936       0.12140936       0.12140936 1.0 
     -0.10791943       0.10791943       0.10791943 1.0 
     -0.09442950       0.09442950       0.09442950 1.0 
     -0.08093957       0.08093957       0.08093957 1.0 
     -0.06744964       0.06744964       0.06744964 1.0 
     -0.05395972       0.05395972       0.05395972 1.0 
     -0.04046979       0.04046979       0.04046979 1.0 
     -0.02697986       0.02697986       0.02697986 1.0 
     -0.01348993       0.01348993       0.01348993 1.0 
      0.00000000       0.00000000       0.00000000 1.0 
      0.00000000       0.00000000       0.00000000 1.0 
      0.02500000       0.02500000      -0.02500000 1.0 
      0.05000000       0.05000000      -0.05000000 1.0 
      0.07500000       0.07500000      -0.07500000 1.0 
      0.10000000       0.10000000      -0.10000000 1.0 
      0.12500000       0.12500000      -0.12500000 1.0 
      0.15000000       0.15000000      -0.15000000 1.0 
      0.17500000       0.17500000      -0.17500000 1.0 
      0.20000000       0.20000000      -0.20000000 1.0 
      0.22500000       0.22500000      -0.22500000 1.0 
      0.25000000       0.25000000      -0.25000000 1.0 
      0.27500000       0.27500000      -0.27500000 1.0 
      0.30000000       0.30000000      -0.30000000 1.0 
      0.32500000       0.32500000      -0.32500000 1.0 
      0.35000000       0.35000000      -0.35000000 1.0 
      0.37500000       0.37500000      -0.37500000 1.0 
      0.40000000       0.40000000      -0.40000000 1.0 
      0.42500000       0.42500000      -0.42500000 1.0 
      0.45000000       0.45000000      -0.45000000 1.0 
      0.47500000       0.47500000      -0.47500000 1.0 
      0.50000000       0.50000000      -0.50000000 1.0 
      0.50000000       0.50000000      -0.50000000 1.0 
      0.48644295       0.51355705      -0.48644295 1.0 
      0.47288589       0.52711411      -0.47288589 1.0 
      0.45932884       0.54067116      -0.45932884 1.0 
      0.44577178       0.55422822      -0.44577178 1.0 
      0.43221473       0.56778527      -0.43221473 1.0 
      0.41865767       0.58134233      -0.41865767 1.0 
      0.40510062       0.59489938      -0.40510062 1.0 
      0.39154357       0.60845643      -0.39154357 1.0 
      0.37798651       0.62201349      -0.37798651 1.0 
      0.36442946       0.63557054      -0.36442946 1.0 
      0.35087240       0.64912760      -0.35087240 1.0 
      0.33731535       0.66268465      -0.33731535 1.0 
      0.32375830       0.67624170      -0.32375830 1.0 
      0.32375830       0.67624170      -0.32375830 1.0 
      0.29677844       0.66155490      -0.29677844 1.0 
      0.26979858       0.64686809      -0.26979858 1.0 
      0.24281872       0.63218128      -0.24281872 1.0 
      0.21583886       0.61749447      -0.21583886 1.0 
      0.18885901       0.60280766      -0.18885901 1.0 
      0.16187915       0.58812085      -0.16187915 1.0 
      0.13489929       0.57343404      -0.13489929 1.0 
      0.10791943       0.55874723      -0.10791943 1.0 
      0.08093957       0.54406043      -0.08093957 1.0 
      0.05395972       0.52937362      -0.05395972 1.0 
      0.02697986       0.51468681      -0.02697986 1.0 
     -0.00000000       0.50000000       0.00000000 1.0 
     -0.00000000       0.50000000       0.00000000 1.0 
      0.01315789       0.48684211       0.01315789 1.0 
      0.02631579       0.47368421       0.02631579 1.0 
      0.03947368       0.46052632       0.03947368 1.0 
      0.05263158       0.44736842       0.05263158 1.0 
      0.06578947       0.43421053       0.06578947 1.0 
      0.07894737       0.42105263       0.07894737 1.0 
      0.09210526       0.40789474       0.09210526 1.0 
      0.10526316       0.39473684       0.10526316 1.0 
      0.11842105       0.38157895       0.11842105 1.0 
      0.13157895       0.36842105       0.13157895 1.0 
      0.14473684       0.35526316       0.14473684 1.0 
      0.15789474       0.34210526       0.15789474 1.0 
      0.17105263       0.32894737       0.17105263 1.0 
      0.18421053       0.31578947       0.18421053 1.0 
      0.19736842       0.30263158       0.19736842 1.0 
      0.21052632       0.28947368       0.21052632 1.0 
      0.22368421       0.27631579       0.22368421 1.0 
      0.23684211       0.26315789       0.23684211 1.0 
      0.25000000       0.25000000       0.25000000 1.0 
      0.25000000       0.25000000       0.25000000 1.0 
      0.26923077       0.26923077       0.21942180 1.0 
      0.28846154       0.28846154       0.18884360 1.0 
      0.30769231       0.30769231       0.15826540 1.0 
      0.32692308       0.32692308       0.12768720 1.0 
      0.34615385       0.34615385       0.09710900 1.0 
      0.36538462       0.36538462       0.06653080 1.0 
      0.38461538       0.38461538       0.03595260 1.0 
      0.40384615       0.40384615       0.00537441 1.0 
      0.42307692       0.42307692      -0.02520379 1.0 
      0.44230769       0.44230769      -0.05578199 1.0 
      0.46153846       0.46153846      -0.08636019 1.0 
      0.48076923       0.48076923      -0.11693839 1.0 
      0.50000000       0.50000000      -0.14751659 1.0 
      0.50000000       0.50000000      -0.14751659 1.0 
      0.50000000       0.50000000      -0.16606835 1.0 
      0.50000000       0.50000000      -0.18462011 1.0 
      0.50000000       0.50000000      -0.20317187 1.0 
      0.50000000       0.50000000      -0.22172362 1.0 
      0.50000000       0.50000000      -0.24027538 1.0 
      0.50000000       0.50000000      -0.25882714 1.0 
      0.50000000       0.50000000      -0.27737890 1.0 
      0.50000000       0.50000000      -0.29593066 1.0 
      0.50000000       0.50000000      -0.31448242 1.0 
      0.50000000       0.50000000      -0.33303417 1.0 
      0.50000000       0.50000000      -0.35158593 1.0 
      0.50000000       0.50000000      -0.37013769 1.0 
      0.50000000       0.50000000      -0.38868945 1.0 
      0.50000000       0.50000000      -0.40724121 1.0 
      0.50000000       0.50000000      -0.42579297 1.0 
      0.50000000       0.50000000      -0.44434472 1.0 
      0.50000000       0.50000000      -0.46289648 1.0 
      0.50000000       0.50000000      -0.48144824 1.0 
      0.50000000       0.50000000      -0.50000000 1.0 
      0.00000000       0.00000000       0.50000000 1.0 
      0.02500000       0.02500000       0.47500000 1.0 
      0.05000000       0.05000000       0.45000000 1.0 
      0.07500000       0.07500000       0.42500000 1.0 
      0.10000000       0.10000000       0.40000000 1.0 
      0.12500000       0.12500000       0.37500000 1.0 
      0.15000000       0.15000000       0.35000000 1.0 
      0.17500000       0.17500000       0.32500000 1.0 
      0.20000000       0.20000000       0.30000000 1.0 
      0.22500000       0.22500000       0.27500000 1.0 
      0.25000000       0.25000000       0.25000000 1.0 

