! Pwscf input file created with ciftopw.py 
! Compound: KMn(SeO4)2
&control
         calculation     = 'bands'
         prefix          = 'KMnxSeO4x2'
         restart_mode    = 'from_scratch'
         outdir          = './'
         wf_collect      = .true.
         verbosity       = 'high'
       /
&system
         ibrav           =  14
         celldm(1)       =            9.1217073489030014
         celldm(2)       =            1.0333540501346592
         celldm(3)       =            1.6534079138181061
         celldm(4)       =            0.1187505714353838
         celldm(5)       =            0.0815906115681576
         celldm(6)       =            0.3759008207205868
         nat             =       12
         ntyp            =        4
         ecutwfc         =       80.00000000
         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 
Mn  54.9380 Mn.rel-pbe-oncvpsp.UPF 
Se  78.9600 Se.rel-pbe-n-rrkjus_psl.1.0.0.UPF 
 K  39.0983 K.rel-pbe-spn-rrkjus_psl.1.0.0.UPF 
ATOMIC_POSITIONS crystal
K_POINTS crystal
257
      0.50000000       0.00000000       0.00000000 1.0 
      0.48611111      -0.00000000       0.00000000 1.0 
      0.47222222       0.00000000       0.00000000 1.0 
      0.45833333       0.00000000       0.00000000 1.0 
      0.44444444       0.00000000       0.00000000 1.0 
      0.43055556       0.00000000       0.00000000 1.0 
      0.41666667      -0.00000000      -0.00000000 1.0 
      0.40277778       0.00000000       0.00000000 1.0 
      0.38888889       0.00000000      -0.00000000 1.0 
      0.37500000       0.00000000      -0.00000000 1.0 
      0.36111111       0.00000000       0.00000000 1.0 
      0.34722222       0.00000000       0.00000000 1.0 
      0.33333333       0.00000000       0.00000000 1.0 
      0.31944444       0.00000000       0.00000000 1.0 
      0.30555556      -0.00000000       0.00000000 1.0 
      0.29166667       0.00000000       0.00000000 1.0 
      0.27777778       0.00000000       0.00000000 1.0 
      0.26388889       0.00000000       0.00000000 1.0 
      0.25000000       0.00000000       0.00000000 1.0 
      0.23611111       0.00000000       0.00000000 1.0 
      0.22222222       0.00000000       0.00000000 1.0 
      0.20833333       0.00000000       0.00000000 1.0 
      0.19444444       0.00000000       0.00000000 1.0 
      0.18055556      -0.00000000       0.00000000 1.0 
      0.16666667       0.00000000      -0.00000000 1.0 
      0.15277778       0.00000000       0.00000000 1.0 
      0.13888889       0.00000000       0.00000000 1.0 
      0.12500000       0.00000000       0.00000000 1.0 
      0.11111111      -0.00000000      -0.00000000 1.0 
      0.09722222      -0.00000000      -0.00000000 1.0 
      0.08333333      -0.00000000      -0.00000000 1.0 
      0.06944444      -0.00000000      -0.00000000 1.0 
      0.05555556       0.00000000      -0.00000000 1.0 
      0.04166667      -0.00000000      -0.00000000 1.0 
      0.02777778      -0.00000000      -0.00000000 1.0 
      0.01388889       0.00000000       0.00000000 1.0 
      0.00000000       0.00000000       0.00000000 1.0 
      0.00000000       0.00000000       0.00000000 1.0 
      0.00000000       0.01428571      -0.00000000 1.0 
      0.00000000       0.02857143      -0.00000000 1.0 
      0.00000000       0.04285714      -0.00000000 1.0 
      0.00000000       0.05714286      -0.00000000 1.0 
      0.00000000       0.07142857       0.00000000 1.0 
      0.00000000       0.08571429      -0.00000000 1.0 
      0.00000000       0.10000000       0.00000000 1.0 
      0.00000000       0.11428571      -0.00000000 1.0 
      0.00000000       0.12857143       0.00000000 1.0 
      0.00000000       0.14285714       0.00000000 1.0 
      0.00000000       0.15714286      -0.00000000 1.0 
      0.00000000       0.17142857      -0.00000000 1.0 
      0.00000000       0.18571429      -0.00000000 1.0 
      0.00000000       0.20000000       0.00000000 1.0 
      0.00000000       0.21428571       0.00000000 1.0 
      0.00000000       0.22857143      -0.00000000 1.0 
      0.00000000       0.24285714       0.00000000 1.0 
      0.00000000       0.25714286       0.00000000 1.0 
      0.00000000       0.27142857       0.00000000 1.0 
      0.00000000       0.28571429       0.00000000 1.0 
      0.00000000       0.30000000      -0.00000000 1.0 
      0.00000000       0.31428571      -0.00000000 1.0 
      0.00000000       0.32857143      -0.00000000 1.0 
      0.00000000       0.34285714      -0.00000000 1.0 
      0.00000000       0.35714286       0.00000000 1.0 
      0.00000000       0.37142857      -0.00000000 1.0 
      0.00000000       0.38571429      -0.00000000 1.0 
      0.00000000       0.40000000       0.00000000 1.0 
      0.00000000       0.41428571      -0.00000000 1.0 
      0.00000000       0.42857143       0.00000000 1.0 
      0.00000000       0.44285714      -0.00000000 1.0 
      0.00000000       0.45714286      -0.00000000 1.0 
      0.00000000       0.47142857       0.00000000 1.0 
      0.00000000       0.48571429       0.00000000 1.0 
      0.00000000       0.50000000       0.00000000 1.0 
      0.50000000       0.50000000       0.00000000 1.0 
      0.48717949       0.48717949       0.00000000 1.0 
      0.47435897       0.47435897       0.00000000 1.0 
      0.46153846       0.46153846       0.00000000 1.0 
      0.44871795       0.44871795       0.00000000 1.0 
      0.43589744       0.43589744       0.00000000 1.0 
      0.42307692       0.42307692       0.00000000 1.0 
      0.41025641       0.41025641       0.00000000 1.0 
      0.39743590       0.39743590       0.00000000 1.0 
      0.38461538       0.38461538       0.00000000 1.0 
      0.37179487       0.37179487      -0.00000000 1.0 
      0.35897436       0.35897436       0.00000000 1.0 
      0.34615385       0.34615385       0.00000000 1.0 
      0.33333333       0.33333333      -0.00000000 1.0 
      0.32051282       0.32051282       0.00000000 1.0 
      0.30769231       0.30769231       0.00000000 1.0 
      0.29487179       0.29487179       0.00000000 1.0 
      0.28205128       0.28205128      -0.00000000 1.0 
      0.26923077       0.26923077      -0.00000000 1.0 
      0.25641026       0.25641026       0.00000000 1.0 
      0.24358974       0.24358974       0.00000000 1.0 
      0.23076923       0.23076923       0.00000000 1.0 
      0.21794872       0.21794872       0.00000000 1.0 
      0.20512821       0.20512821       0.00000000 1.0 
      0.19230769       0.19230769       0.00000000 1.0 
      0.17948718       0.17948718      -0.00000000 1.0 
      0.16666667       0.16666667       0.00000000 1.0 
      0.15384615       0.15384615       0.00000000 1.0 
      0.14102564       0.14102564      -0.00000000 1.0 
      0.12820513       0.12820513       0.00000000 1.0 
      0.11538462       0.11538462      -0.00000000 1.0 
      0.10256410       0.10256410      -0.00000000 1.0 
      0.08974359       0.08974359      -0.00000000 1.0 
      0.07692308       0.07692308       0.00000000 1.0 
      0.06410256       0.06410256      -0.00000000 1.0 
      0.05128205       0.05128205       0.00000000 1.0 
      0.03846154       0.03846154      -0.00000000 1.0 
      0.02564103       0.02564103       0.00000000 1.0 
      0.01282051       0.01282051       0.00000000 1.0 
      0.00000000       0.00000000       0.00000000 1.0 
      0.00000000       0.00000000       0.00000000 1.0 
      0.00000000       0.00000000       0.02500000 1.0 
      0.00000000       0.00000000       0.05000000 1.0 
      0.00000000       0.00000000       0.07500000 1.0 
      0.00000000       0.00000000       0.10000000 1.0 
      0.00000000       0.00000000       0.12500000 1.0 
      0.00000000       0.00000000       0.15000000 1.0 
      0.00000000       0.00000000       0.17500000 1.0 
      0.00000000       0.00000000       0.20000000 1.0 
      0.00000000       0.00000000       0.22500000 1.0 
      0.00000000       0.00000000       0.25000000 1.0 
      0.00000000       0.00000000       0.27500000 1.0 
      0.00000000       0.00000000       0.30000000 1.0 
      0.00000000       0.00000000       0.32500000 1.0 
      0.00000000       0.00000000       0.35000000 1.0 
      0.00000000       0.00000000       0.37500000 1.0 
      0.00000000       0.00000000       0.40000000 1.0 
      0.00000000       0.00000000       0.42500000 1.0 
      0.00000000       0.00000000       0.45000000 1.0 
      0.00000000       0.00000000       0.47500000 1.0 
      0.00000000       0.00000000       0.50000000 1.0 
      0.50000000       0.00000000       0.50000000 1.0 
      0.48750000      -0.00000000       0.48750000 1.0 
      0.47500000       0.00000000       0.47500000 1.0 
      0.46250000       0.00000000       0.46250000 1.0 
      0.45000000       0.00000000       0.45000000 1.0 
      0.43750000      -0.00000000       0.43750000 1.0 
      0.42500000       0.00000000       0.42500000 1.0 
      0.41250000       0.00000000       0.41250000 1.0 
      0.40000000       0.00000000       0.40000000 1.0 
      0.38750000       0.00000000       0.38750000 1.0 
      0.37500000       0.00000000       0.37500000 1.0 
      0.36250000       0.00000000       0.36250000 1.0 
      0.35000000       0.00000000       0.35000000 1.0 
      0.33750000       0.00000000       0.33750000 1.0 
      0.32500000       0.00000000       0.32500000 1.0 
      0.31250000       0.00000000       0.31250000 1.0 
      0.30000000      -0.00000000       0.30000000 1.0 
      0.28750000       0.00000000       0.28750000 1.0 
      0.27500000       0.00000000       0.27500000 1.0 
      0.26250000       0.00000000       0.26250000 1.0 
      0.25000000       0.00000000       0.25000000 1.0 
      0.23750000       0.00000000       0.23750000 1.0 
      0.22500000       0.00000000       0.22500000 1.0 
      0.21250000       0.00000000       0.21250000 1.0 
      0.20000000      -0.00000000       0.20000000 1.0 
      0.18750000      -0.00000000       0.18750000 1.0 
      0.17500000       0.00000000       0.17500000 1.0 
      0.16250000       0.00000000       0.16250000 1.0 
      0.15000000       0.00000000       0.15000000 1.0 
      0.13750000       0.00000000       0.13750000 1.0 
      0.12500000       0.00000000       0.12500000 1.0 
      0.11250000       0.00000000       0.11250000 1.0 
      0.10000000       0.00000000       0.10000000 1.0 
      0.08750000       0.00000000       0.08750000 1.0 
      0.07500000       0.00000000       0.07500000 1.0 
      0.06250000       0.00000000       0.06250000 1.0 
      0.05000000       0.00000000       0.05000000 1.0 
      0.03750000      -0.00000000       0.03750000 1.0 
      0.02500000       0.00000000       0.02500000 1.0 
      0.01250000       0.00000000       0.01250000 1.0 
      0.00000000       0.00000000       0.00000000 1.0 
      0.00000000       0.00000000       0.00000000 1.0 
      0.00000000       0.01315789       0.01315789 1.0 
      0.00000000       0.02631579       0.02631579 1.0 
      0.00000000       0.03947368       0.03947368 1.0 
      0.00000000       0.05263158       0.05263158 1.0 
      0.00000000       0.06578947       0.06578947 1.0 
      0.00000000       0.07894737       0.07894737 1.0 
      0.00000000       0.09210526       0.09210526 1.0 
      0.00000000       0.10526316       0.10526316 1.0 
      0.00000000       0.11842105       0.11842105 1.0 
      0.00000000       0.13157895       0.13157895 1.0 
      0.00000000       0.14473684       0.14473684 1.0 
      0.00000000       0.15789474       0.15789474 1.0 
      0.00000000       0.17105263       0.17105263 1.0 
      0.00000000       0.18421053       0.18421053 1.0 
      0.00000000       0.19736842       0.19736842 1.0 
      0.00000000       0.21052632       0.21052632 1.0 
      0.00000000       0.22368421       0.22368421 1.0 
      0.00000000       0.23684211       0.23684211 1.0 
      0.00000000       0.25000000       0.25000000 1.0 
      0.00000000       0.26315789       0.26315789 1.0 
      0.00000000       0.27631579       0.27631579 1.0 
      0.00000000       0.28947368       0.28947368 1.0 
      0.00000000       0.30263158       0.30263158 1.0 
      0.00000000       0.31578947       0.31578947 1.0 
      0.00000000       0.32894737       0.32894737 1.0 
      0.00000000       0.34210526       0.34210526 1.0 
      0.00000000       0.35526316       0.35526316 1.0 
      0.00000000       0.36842105       0.36842105 1.0 
      0.00000000       0.38157895       0.38157895 1.0 
      0.00000000       0.39473684       0.39473684 1.0 
      0.00000000       0.40789474       0.40789474 1.0 
      0.00000000       0.42105263       0.42105263 1.0 
      0.00000000       0.43421053       0.43421053 1.0 
      0.00000000       0.44736842       0.44736842 1.0 
      0.00000000       0.46052632       0.46052632 1.0 
      0.00000000       0.47368421       0.47368421 1.0 
      0.00000000       0.48684211       0.48684211 1.0 
      0.00000000       0.50000000       0.50000000 1.0 
      0.50000000       0.50000000       0.50000000 1.0 
      0.48809524       0.48809524       0.48809524 1.0 
      0.47619048       0.47619048       0.47619048 1.0 
      0.46428571       0.46428571       0.46428571 1.0 
      0.45238095       0.45238095       0.45238095 1.0 
      0.44047619       0.44047619       0.44047619 1.0 
      0.42857143       0.42857143       0.42857143 1.0 
      0.41666667       0.41666667       0.41666667 1.0 
      0.40476190       0.40476190       0.40476190 1.0 
      0.39285714       0.39285714       0.39285714 1.0 
      0.38095238       0.38095238       0.38095238 1.0 
      0.36904762       0.36904762       0.36904762 1.0 
      0.35714286       0.35714286       0.35714286 1.0 
      0.34523810       0.34523810       0.34523810 1.0 
      0.33333333       0.33333333       0.33333333 1.0 
      0.32142857       0.32142857       0.32142857 1.0 
      0.30952381       0.30952381       0.30952381 1.0 
      0.29761905       0.29761905       0.29761905 1.0 
      0.28571429       0.28571429       0.28571429 1.0 
      0.27380952       0.27380952       0.27380952 1.0 
      0.26190476       0.26190476       0.26190476 1.0 
      0.25000000       0.25000000       0.25000000 1.0 
      0.23809524       0.23809524       0.23809524 1.0 
      0.22619048       0.22619048       0.22619048 1.0 
      0.21428571       0.21428571       0.21428571 1.0 
      0.20238095       0.20238095       0.20238095 1.0 
      0.19047619       0.19047619       0.19047619 1.0 
      0.17857143       0.17857143       0.17857143 1.0 
      0.16666667       0.16666667       0.16666667 1.0 
      0.15476190       0.15476190       0.15476190 1.0 
      0.14285714       0.14285714       0.14285714 1.0 
      0.13095238       0.13095238       0.13095238 1.0 
      0.11904762       0.11904762       0.11904762 1.0 
      0.10714286       0.10714286       0.10714286 1.0 
      0.09523810       0.09523810       0.09523810 1.0 
      0.08333333       0.08333333       0.08333333 1.0 
      0.07142857       0.07142857       0.07142857 1.0 
      0.05952381       0.05952381       0.05952381 1.0 
      0.04761905       0.04761905       0.04761905 1.0 
      0.03571429       0.03571429       0.03571429 1.0 
      0.02380952       0.02380952       0.02380952 1.0 
      0.01190476       0.01190476       0.01190476 1.0 
      0.00000000       0.00000000       0.00000000 1.0 

