! Pwscf input file created with ciftopw.py 
! Compound: Si5Ir4
&control
         calculation     = 'bands'
         prefix          = 'Si5Ir4'
         restart_mode    = 'from_scratch'
         outdir          = './'
         wf_collect      = .true.
         verbosity       = 'high'
       /
&system
         ibrav           =  14
         celldm(1)       =            6.8372176008009005
         celldm(2)       =            1.6253005721234899
         celldm(3)       =            3.4158812636466651
         celldm(4)       =            0.1760539961798261
         celldm(5)       =            0.0000000000000001
         celldm(6)       =            0.0000000000000001
         nat             =       18
         ntyp            =        2
         ecutwfc         =       57.00000000
         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
Ir 192.2170 Ir.rel-pbe-spn-rrkjus_psl.1.0.0.UPF 
Si  28.0855 Si.rel-pbe-n-rrkjus_psl.1.0.0.UPF 
ATOMIC_POSITIONS crystal
K_POINTS crystal
249
      0.00000000       0.00000000       0.00000000 1.0 
      0.00000000       0.00000000       0.03846154 1.0 
      0.00000000       0.00000000       0.07692308 1.0 
      0.00000000       0.00000000       0.11538462 1.0 
      0.00000000       0.00000000       0.15384615 1.0 
      0.00000000       0.00000000       0.19230769 1.0 
      0.00000000       0.00000000       0.23076923 1.0 
      0.00000000       0.00000000       0.26923077 1.0 
      0.00000000       0.00000000       0.30769231 1.0 
      0.00000000       0.00000000       0.34615385 1.0 
      0.00000000       0.00000000       0.38461538 1.0 
      0.00000000       0.00000000       0.42307692 1.0 
      0.00000000       0.00000000       0.46153846 1.0 
      0.00000000       0.00000000       0.50000000 1.0 
      0.00000000       0.00000000       0.50000000 1.0 
      0.00000000       0.01818345       0.50672808 1.0 
      0.00000000       0.03636689       0.51345616 1.0 
      0.00000000       0.05455034       0.52018424 1.0 
      0.00000000       0.07273379       0.52691232 1.0 
      0.00000000       0.09091724       0.53364040 1.0 
      0.00000000       0.10910068       0.54036848 1.0 
      0.00000000       0.12728413       0.54709656 1.0 
      0.00000000       0.14546758       0.55382464 1.0 
      0.00000000       0.16365103       0.56055273 1.0 
      0.00000000       0.18183447       0.56728081 1.0 
      0.00000000       0.20001792       0.57400889 1.0 
      0.00000000       0.21820137       0.58073697 1.0 
      0.00000000       0.23638481       0.58746505 1.0 
      0.00000000       0.25456826       0.59419313 1.0 
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      0.00000000       0.29093516       0.60764929 1.0 
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      0.00000000       0.36366894       0.63456161 1.0 
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      0.00000000       0.47276963       0.67493010 1.0 
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      0.00000000       0.47821570       0.63994408 1.0 
      0.00000000       0.48366178       0.60495806 1.0 
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      0.00000000       0.49455393       0.53498602 1.0 
      0.00000000       0.50000000       0.50000000 1.0 
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      0.03409091       0.50000000       0.50000000 1.0 
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      0.11363636       0.50000000       0.50000000 1.0 
      0.12500000       0.50000000       0.50000000 1.0 
      0.13636364       0.50000000       0.50000000 1.0 
      0.14772727       0.50000000       0.50000000 1.0 
      0.15909091       0.50000000       0.50000000 1.0 
      0.17045455       0.50000000       0.50000000 1.0 
      0.18181818       0.50000000       0.50000000 1.0 
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      0.25000000       0.50000000       0.50000000 1.0 
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      0.27272727       0.50000000       0.50000000 1.0 
      0.28409091       0.50000000       0.50000000 1.0 
      0.29545455       0.50000000       0.50000000 1.0 
      0.30681818       0.50000000       0.50000000 1.0 
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      0.32954545       0.50000000       0.50000000 1.0 
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      0.37500000       0.50000000       0.50000000 1.0 
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      0.39772727       0.50000000       0.50000000 1.0 
      0.40909091       0.50000000       0.50000000 1.0 
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      0.50000000       0.51089215       0.43002796 1.0 
      0.50000000       0.51633822       0.39504194 1.0 
      0.50000000       0.52178430       0.36005592 1.0 
      0.50000000       0.52723037       0.32506990 1.0 
      0.50000000       0.52723037       0.32506990 1.0 
      0.50000000       0.52420478       0.28895103 1.0 
      0.50000000       0.52117918       0.25283215 1.0 
      0.50000000       0.51815358       0.21671327 1.0 
      0.50000000       0.51512798       0.18059439 1.0 
      0.50000000       0.51210239       0.14447551 1.0 
      0.50000000       0.50907679       0.10835663 1.0 
      0.50000000       0.50605119       0.07223776 1.0 
      0.50000000       0.50302560       0.03611888 1.0 
      0.50000000       0.50000000      -0.00000000 1.0 
      0.50000000       0.50000000       0.00000000 1.0 
      0.48863636       0.50000000       0.00000000 1.0 
      0.47727273       0.50000000       0.00000000 1.0 
      0.46590909       0.50000000       0.00000000 1.0 
      0.45454545       0.50000000       0.00000000 1.0 
      0.44318182       0.50000000       0.00000000 1.0 
      0.43181818       0.50000000       0.00000000 1.0 
      0.42045455       0.50000000       0.00000000 1.0 
      0.40909091       0.50000000       0.00000000 1.0 
      0.39772727       0.50000000       0.00000000 1.0 
      0.38636364       0.50000000       0.00000000 1.0 
      0.37500000       0.50000000       0.00000000 1.0 
      0.36363636       0.50000000       0.00000000 1.0 
      0.35227273       0.50000000       0.00000000 1.0 
      0.34090909       0.50000000       0.00000000 1.0 
      0.32954545       0.50000000       0.00000000 1.0 
      0.31818182       0.50000000       0.00000000 1.0 
      0.30681818       0.50000000       0.00000000 1.0 
      0.29545455       0.50000000       0.00000000 1.0 
      0.28409091       0.50000000       0.00000000 1.0 
      0.27272727       0.50000000       0.00000000 1.0 
      0.26136364       0.50000000       0.00000000 1.0 
      0.25000000       0.50000000       0.00000000 1.0 
      0.23863636       0.50000000       0.00000000 1.0 
      0.22727273       0.50000000       0.00000000 1.0 
      0.21590909       0.50000000       0.00000000 1.0 
      0.20454545       0.50000000       0.00000000 1.0 
      0.19318182       0.50000000       0.00000000 1.0 
      0.18181818       0.50000000       0.00000000 1.0 
      0.17045455       0.50000000       0.00000000 1.0 
      0.15909091       0.50000000       0.00000000 1.0 
      0.14772727       0.50000000       0.00000000 1.0 
      0.13636364       0.50000000       0.00000000 1.0 
      0.12500000       0.50000000       0.00000000 1.0 
      0.11363636       0.50000000       0.00000000 1.0 
      0.10227273       0.50000000       0.00000000 1.0 
      0.09090909       0.50000000       0.00000000 1.0 
      0.07954545       0.50000000       0.00000000 1.0 
      0.06818182       0.50000000       0.00000000 1.0 
      0.05681818       0.50000000       0.00000000 1.0 
      0.04545455       0.50000000       0.00000000 1.0 
      0.03409091       0.50000000       0.00000000 1.0 
      0.02272727       0.50000000       0.00000000 1.0 
      0.01136364       0.50000000       0.00000000 1.0 
      0.00000000       0.50000000       0.00000000 1.0 
      0.00000000       0.50000000       0.00000000 1.0 
      0.00000000       0.50302560       0.03611888 1.0 
      0.00000000       0.50605119       0.07223776 1.0 
      0.00000000       0.50907679       0.10835663 1.0 
      0.00000000       0.51210239       0.14447551 1.0 
      0.00000000       0.51512798       0.18059439 1.0 
      0.00000000       0.51815358       0.21671327 1.0 
      0.00000000       0.52117918       0.25283215 1.0 
      0.00000000       0.52420478       0.28895103 1.0 
      0.00000000       0.52723037       0.32506990 1.0 
      0.50000000       0.47276963       0.67493010 1.0 
      0.50000000       0.45458618       0.66820202 1.0 
      0.50000000       0.43640273       0.66147393 1.0 
      0.50000000       0.41821929       0.65474585 1.0 
      0.50000000       0.40003584       0.64801777 1.0 
      0.50000000       0.38185239       0.64128969 1.0 
      0.50000000       0.36366894       0.63456161 1.0 
      0.50000000       0.34548550       0.62783353 1.0 
      0.50000000       0.32730205       0.62110545 1.0 
      0.50000000       0.30911860       0.61437737 1.0 
      0.50000000       0.29093516       0.60764929 1.0 
      0.50000000       0.27275171       0.60092121 1.0 
      0.50000000       0.25456826       0.59419313 1.0 
      0.50000000       0.23638481       0.58746505 1.0 
      0.50000000       0.21820137       0.58073697 1.0 
      0.50000000       0.20001792       0.57400889 1.0 
      0.50000000       0.18183447       0.56728081 1.0 
      0.50000000       0.16365103       0.56055273 1.0 
      0.50000000       0.14546758       0.55382464 1.0 
      0.50000000       0.12728413       0.54709656 1.0 
      0.50000000       0.10910068       0.54036848 1.0 
      0.50000000       0.09091724       0.53364040 1.0 
      0.50000000       0.07273379       0.52691232 1.0 
      0.50000000       0.05455034       0.52018424 1.0 
      0.50000000       0.03636689       0.51345616 1.0 
      0.50000000       0.01818345       0.50672808 1.0 
      0.50000000       0.00000000       0.50000000 1.0 
      0.50000000       0.00000000       0.50000000 1.0 
      0.50000000       0.00000000       0.46153846 1.0 
      0.50000000       0.00000000       0.42307692 1.0 
      0.50000000       0.00000000       0.38461538 1.0 
      0.50000000       0.00000000       0.34615385 1.0 
      0.50000000       0.00000000       0.30769231 1.0 
      0.50000000       0.00000000       0.26923077 1.0 
      0.50000000       0.00000000       0.23076923 1.0 
      0.50000000       0.00000000       0.19230769 1.0 
      0.50000000       0.00000000       0.15384615 1.0 
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      0.50000000       0.00000000       0.03846154 1.0 
      0.50000000       0.00000000       0.00000000 1.0 
      0.00000000       0.00000000       0.50000000 1.0 
      0.01136364       0.00000000       0.50000000 1.0 
      0.02272727       0.00000000       0.50000000 1.0 
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      0.04545455       0.00000000       0.50000000 1.0 
      0.05681818       0.00000000       0.50000000 1.0 
      0.06818182       0.00000000       0.50000000 1.0 
      0.07954545       0.00000000       0.50000000 1.0 
      0.09090909       0.00000000       0.50000000 1.0 
      0.10227273       0.00000000       0.50000000 1.0 
      0.11363636       0.00000000       0.50000000 1.0 
      0.12500000       0.00000000       0.50000000 1.0 
      0.13636364       0.00000000       0.50000000 1.0 
      0.14772727       0.00000000       0.50000000 1.0 
      0.15909091       0.00000000       0.50000000 1.0 
      0.17045455       0.00000000       0.50000000 1.0 
      0.18181818       0.00000000       0.50000000 1.0 
      0.19318182       0.00000000       0.50000000 1.0 
      0.20454545       0.00000000       0.50000000 1.0 
      0.21590909       0.00000000       0.50000000 1.0 
      0.22727273       0.00000000       0.50000000 1.0 
      0.23863636       0.00000000       0.50000000 1.0 
      0.25000000       0.00000000       0.50000000 1.0 
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      0.27272727       0.00000000       0.50000000 1.0 
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      0.50000000       0.00000000       0.50000000 1.0 

