! Pwscf input file created with ciftopw.py 
! Compound: Na2Cr2O7
&control
         calculation     = 'bands'
         prefix          = 'Na2Cr2O7'
         restart_mode    = 'from_scratch'
         outdir          = './'
         wf_collect      = .true.
         verbosity       = 'high'
       /
&system
         ibrav           =  14
         celldm(1)       =           13.2488605599545188
         celldm(2)       =            1.0087351010689856
         celldm(3)       =            1.0418656837691846
         celldm(4)       =           -0.4086400340844953
         celldm(5)       =            0.0158357609062555
         celldm(6)       =           -0.0822754786046127
         nat             =       22
         ntyp            =        3
         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 
Cr  51.9961 Cr.rel-pbe-oncvpsp.UPF 
Na  22.9898 Na.rel-pbe-spnl-rrkjus_psl.1.0.0.UPF 
ATOMIC_POSITIONS crystal
K_POINTS crystal
207
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     -0.24242424      -0.00000000       0.24242424 1.0 
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     -0.50000000       0.00000000       0.50000000 1.0 
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     -0.48611111      -0.48611111       0.48611111 1.0 
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     -0.34722222      -0.34722222       0.34722222 1.0 
     -0.33333333      -0.33333333       0.33333333 1.0 
     -0.31944444      -0.31944444       0.31944444 1.0 
     -0.30555556      -0.30555556       0.30555556 1.0 
     -0.29166667      -0.29166667       0.29166667 1.0 
     -0.27777778      -0.27777778       0.27777778 1.0 
     -0.26388889      -0.26388889       0.26388889 1.0 
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     -0.15277778      -0.15277778       0.15277778 1.0 
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