! Pwscf input file created with ciftopw.py 
! Compound: MnTl(VS2)4
&control
         calculation     = 'bands'
         prefix          = 'MnTlxVS2x4'
         restart_mode    = 'from_scratch'
         outdir          = './'
         wf_collect      = .true.
         verbosity       = 'high'
       /
&system
         ibrav           =  14
         celldm(1)       =           16.7997714416480193
         celldm(2)       =            1.0000000000000000
         celldm(3)       =            0.9578116495349480
         celldm(4)       =            0.2373831732846663
         celldm(5)       =            0.2373831732846663
         celldm(6)       =            0.9310630637522487
         nat             =       14
         ntyp            =        4
         ecutwfc         =       80.00000000
         ecutrho         =      646.00000000
         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
 S  32.0650 S.rel-pbe-n-rrkjus_psl.1.0.0.UPF 
Tl 204.3833 Tl.rel-pbe-dn-rrkjus_psl.1.0.0.UPF 
 V  50.9415 V.rel-pbe-spnl-rrkjus_psl.1.0.0.UPF 
Mn  54.9380 Mn.rel-pbe-oncvpsp.UPF 
ATOMIC_POSITIONS crystal
K_POINTS crystal
358
      0.00000000       0.00000000       0.00000000 1.0 
      0.02631579       0.02631579       0.00000000 1.0 
      0.05263158       0.05263158       0.00000000 1.0 
      0.07894737       0.07894737       0.00000000 1.0 
      0.10526316       0.10526316       0.00000000 1.0 
      0.13157895       0.13157895       0.00000000 1.0 
      0.15789474       0.15789474       0.00000000 1.0 
      0.18421053       0.18421053       0.00000000 1.0 
      0.21052632       0.21052632       0.00000000 1.0 
      0.23684211       0.23684211       0.00000000 1.0 
      0.26315789       0.26315789       0.00000000 1.0 
      0.28947368       0.28947368       0.00000000 1.0 
      0.31578947       0.31578947       0.00000000 1.0 
      0.34210526       0.34210526       0.00000000 1.0 
      0.36842105       0.36842105       0.00000000 1.0 
      0.39473684       0.39473684       0.00000000 1.0 
      0.42105263       0.42105263       0.00000000 1.0 
      0.44736842       0.44736842       0.00000000 1.0 
      0.47368421       0.47368421       0.00000000 1.0 
      0.50000000       0.50000000       0.00000000 1.0 
      0.50000000       0.50000000       0.00000000 1.0 
      0.50670735       0.50670735       0.02706331 1.0 
      0.51341469       0.51341469       0.05412662 1.0 
      0.52012204       0.52012204       0.08118992 1.0 
      0.52682938       0.52682938       0.10825323 1.0 
      0.53353673       0.53353673       0.13531654 1.0 
      0.54024407       0.54024407       0.16237985 1.0 
      0.54695142       0.54695142       0.18944315 1.0 
      0.55365877       0.55365877       0.21650646 1.0 
      0.56036611       0.56036611       0.24356977 1.0 
      0.56707346       0.56707346       0.27063308 1.0 
      0.57378080       0.57378080       0.29769639 1.0 
      0.58048815       0.58048815       0.32475969 1.0 
      0.58719549       0.58719549       0.35182300 1.0 
      0.59390284       0.59390284       0.37888631 1.0 
      0.60061019       0.60061019       0.40594962 1.0 
      0.60061019       0.60061019       0.40594962 1.0 
      0.58384182       0.58384182       0.42162468 1.0 
      0.56707346       0.56707346       0.43729974 1.0 
      0.55030509       0.55030509       0.45297481 1.0 
      0.53353673       0.53353673       0.46864987 1.0 
      0.51676836       0.51676836       0.48432494 1.0 
      0.50000000       0.50000000       0.50000000 1.0 
      0.50000000       0.50000000       0.50000000 1.0 
      0.50521745       0.49478255       0.50000000 1.0 
      0.51043490       0.48956510       0.50000000 1.0 
      0.51565235       0.48434765       0.50000000 1.0 
      0.52086980       0.47913020       0.50000000 1.0 
      0.52608724       0.47391276       0.50000000 1.0 
      0.53130469       0.46869531       0.50000000 1.0 
      0.53652214       0.46347786       0.50000000 1.0 
      0.54173959       0.45826041       0.50000000 1.0 
      0.54695704       0.45304296       0.50000000 1.0 
      0.55217449       0.44782551       0.50000000 1.0 
      0.55739194       0.44260806       0.50000000 1.0 
      0.56260939       0.43739061       0.50000000 1.0 
      0.56782683       0.43217317       0.50000000 1.0 
      0.57304428       0.42695572       0.50000000 1.0 
      0.57826173       0.42173827       0.50000000 1.0 
      0.58347918       0.41652082       0.50000000 1.0 
      0.58869663       0.41130337       0.50000000 1.0 
      0.59391408       0.40608592       0.50000000 1.0 
      0.59913153       0.40086847       0.50000000 1.0 
      0.60434898       0.39565102       0.50000000 1.0 
      0.60956642       0.39043358       0.50000000 1.0 
      0.61478387       0.38521613       0.50000000 1.0 
      0.62000132       0.37999868       0.50000000 1.0 
      0.62521877       0.37478123       0.50000000 1.0 
      0.63043622       0.36956378       0.50000000 1.0 
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      0.64608857       0.35391143       0.50000000 1.0 
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      0.66174091       0.33825909       0.50000000 1.0 
      0.66695836       0.33304164       0.50000000 1.0 
      0.67217581       0.32782419       0.50000000 1.0 
      0.67739326       0.32260674       0.50000000 1.0 
      0.68261071       0.31738929       0.50000000 1.0 
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      0.72435030       0.27564970       0.50000000 1.0 
      0.72956775       0.27043225       0.50000000 1.0 
      0.73478519       0.26521481       0.50000000 1.0 
      0.74000264       0.25999736       0.50000000 1.0 
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      0.25477991      -0.25477991       0.50000000 1.0 
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      0.16638688      -0.16638688       0.50000000 1.0 
      0.16118729      -0.16118729       0.50000000 1.0 
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      0.10919139      -0.10919139       0.50000000 1.0 
      0.10399180      -0.10399180       0.50000000 1.0 
      0.09879221      -0.09879221       0.50000000 1.0 
      0.09359262      -0.09359262       0.50000000 1.0 
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      0.18269231       0.00000000       0.18269231 1.0 
      0.17307692       0.00000000       0.17307692 1.0 
      0.16346154       0.00000000       0.16346154 1.0 
      0.15384615       0.00000000       0.15384615 1.0 
      0.14423077      -0.00000000       0.14423077 1.0 
      0.13461538       0.00000000       0.13461538 1.0 
      0.12500000      -0.00000000       0.12500000 1.0 
      0.11538462      -0.00000000       0.11538462 1.0 
      0.10576923       0.00000000       0.10576923 1.0 
      0.09615385      -0.00000000       0.09615385 1.0 
      0.08653846      -0.00000000       0.08653846 1.0 
      0.07692308       0.00000000       0.07692308 1.0 
      0.06730769       0.00000000       0.06730769 1.0 
      0.05769231       0.00000000       0.05769231 1.0 
      0.04807692       0.00000000       0.04807692 1.0 
      0.03846154      -0.00000000       0.03846154 1.0 
      0.02884615       0.00000000       0.02884615 1.0 
      0.01923077       0.00000000       0.01923077 1.0 
      0.00961538      -0.00000000       0.00961538 1.0 
      0.00000000       0.00000000       0.00000000 1.0 

