! Pwscf input file created with ciftopw.py 
! Compound: MnS2
&control
         calculation     = 'bands'
         prefix          = 'MnS2'
         restart_mode    = 'from_scratch'
         outdir          = './'
         wf_collect      = .true.
         verbosity       = 'high'
       /
&system
         ibrav           =  14
         celldm(1)       =            6.4628628823799996
         celldm(2)       =            1.2953216374269008
         celldm(3)       =            1.6081871345029239
         celldm(4)       =            0.0000000000000001
         celldm(5)       =            0.0000000000000001
         celldm(6)       =            0.0000000000000001
         nat             =        6
         ntyp            =        2
         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
 S  32.0650 S.rel-pbe-n-rrkjus_psl.1.0.0.UPF 
Mn  54.9380 Mn.rel-pbe-oncvpsp.UPF 
ATOMIC_POSITIONS crystal
K_POINTS crystal
456
      0.00000000       0.00000000       0.00000000 1.0 
      0.01086957      -0.00000000       0.00000000 1.0 
      0.02173913      -0.00000000       0.00000000 1.0 
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      0.08695652      -0.00000000       0.00000000 1.0 
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      0.13043478       0.00000000       0.00000000 1.0 
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      0.17391304      -0.00000000       0.00000000 1.0 
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      0.25000000      -0.00000000       0.00000000 1.0 
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      0.27173913      -0.00000000       0.00000000 1.0 
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      0.50000000       0.36111111       0.00000000 1.0 
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      0.02173913       0.50000000       0.00000000 1.0 
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      0.00000000       0.48611111       0.00000000 1.0 
      0.00000000       0.47222222       0.00000000 1.0 
      0.00000000       0.45833333       0.00000000 1.0 
      0.00000000       0.44444444       0.00000000 1.0 
      0.00000000       0.43055556       0.00000000 1.0 
      0.00000000       0.41666667       0.00000000 1.0 
      0.00000000       0.40277778       0.00000000 1.0 
      0.00000000       0.38888889       0.00000000 1.0 
      0.00000000       0.37500000       0.00000000 1.0 
      0.00000000       0.36111111       0.00000000 1.0 
      0.00000000       0.34722222       0.00000000 1.0 
      0.00000000       0.33333333       0.00000000 1.0 
      0.00000000       0.31944444       0.00000000 1.0 
      0.00000000       0.30555556       0.00000000 1.0 
      0.00000000       0.29166667       0.00000000 1.0 
      0.00000000       0.27777778       0.00000000 1.0 
      0.00000000       0.26388889       0.00000000 1.0 
      0.00000000       0.25000000       0.00000000 1.0 
      0.00000000       0.23611111       0.00000000 1.0 
      0.00000000       0.22222222       0.00000000 1.0 
      0.00000000       0.20833333       0.00000000 1.0 
      0.00000000       0.19444444       0.00000000 1.0 
      0.00000000       0.18055556       0.00000000 1.0 
      0.00000000       0.16666667       0.00000000 1.0 
      0.00000000       0.15277778       0.00000000 1.0 
      0.00000000       0.13888889       0.00000000 1.0 
      0.00000000       0.12500000       0.00000000 1.0 
      0.00000000       0.11111111       0.00000000 1.0 
      0.00000000       0.09722222       0.00000000 1.0 
      0.00000000       0.08333333       0.00000000 1.0 
      0.00000000       0.06944444       0.00000000 1.0 
      0.00000000       0.05555556       0.00000000 1.0 
      0.00000000       0.04166667       0.00000000 1.0 
      0.00000000       0.02777778       0.00000000 1.0 
      0.00000000       0.01388889       0.00000000 1.0 
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      0.00000000       0.00000000       0.01724138 1.0 
      0.00000000       0.00000000       0.03448276 1.0 
     -0.00000000      -0.00000000       0.05172414 1.0 
      0.00000000       0.00000000       0.06896552 1.0 
      0.00000000       0.00000000       0.08620690 1.0 
     -0.00000000      -0.00000000       0.10344828 1.0 
      0.00000000       0.00000000       0.12068966 1.0 
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      0.00000000       0.00000000       0.15517241 1.0 
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     -0.00000000      -0.00000000       0.20689655 1.0 
      0.00000000       0.00000000       0.22413793 1.0 
      0.00000000       0.00000000       0.24137931 1.0 
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      0.00000000       0.00000000       0.31034483 1.0 
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      0.00000000       0.00000000       0.37931034 1.0 
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     -0.00000000      -0.00000000       0.41379310 1.0 
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      0.00000000       0.00000000       0.44827586 1.0 
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      0.00000000       0.00000000       0.48275862 1.0 
      0.00000000       0.00000000       0.50000000 1.0 
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      0.06521739       0.00000000       0.50000000 1.0 
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      0.10869565       0.00000000       0.50000000 1.0 
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      0.13043478      -0.00000000       0.50000000 1.0 
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      0.15217391       0.00000000       0.50000000 1.0 
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      0.50000000      -0.00000000       0.24137931 1.0 
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      0.50000000       0.50000000       0.48275862 1.0 
      0.50000000       0.50000000       0.50000000 1.0 

