! Pwscf input file created with ciftopw.py 
! Compound: Tl2PdCl4
&control
         calculation     = 'bands'
         prefix          = 'Tl2PdCl4'
         restart_mode    = 'from_scratch'
         outdir          = './'
         wf_collect      = .true.
         verbosity       = 'high'
       /
&system
         ibrav           =  14
         celldm(1)       =           13.5361072592070002
         celldm(2)       =            1.0000000000000000
         celldm(3)       =            0.5977942202987575
         celldm(4)       =            0.0000000000000001
         celldm(5)       =            0.0000000000000001
         celldm(6)       =            0.0000000000000001
         nat             =        7
         ntyp            =        3
         ecutwfc         =       59.00000000
         ecutrho         =      545.00000000
         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
Tl 204.3833 Tl.rel-pbe-dn-rrkjus_psl.1.0.0.UPF 
Pd 106.4200 Pd.rel-pbe-spn-rrkjus_psl.1.0.0.UPF 
Cl  35.4530 Cl.rel-pbe-n-rrkjus_psl.1.0.0.UPF 
ATOMIC_POSITIONS crystal
K_POINTS crystal
272
      0.00000000       0.00000000       0.00000000 1.0 
      0.00000000       0.02272727       0.00000000 1.0 
      0.00000000       0.04545455       0.00000000 1.0 
      0.00000000       0.06818182       0.00000000 1.0 
      0.00000000       0.09090909       0.00000000 1.0 
      0.00000000       0.11363636       0.00000000 1.0 
      0.00000000       0.13636364       0.00000000 1.0 
      0.00000000       0.15909091       0.00000000 1.0 
      0.00000000       0.18181818       0.00000000 1.0 
      0.00000000       0.20454545       0.00000000 1.0 
      0.00000000       0.22727273       0.00000000 1.0 
      0.00000000       0.25000000       0.00000000 1.0 
      0.00000000       0.27272727       0.00000000 1.0 
      0.00000000       0.29545455       0.00000000 1.0 
      0.00000000       0.31818182       0.00000000 1.0 
      0.00000000       0.34090909       0.00000000 1.0 
      0.00000000       0.36363636       0.00000000 1.0 
      0.00000000       0.38636364       0.00000000 1.0 
      0.00000000       0.40909091       0.00000000 1.0 
      0.00000000       0.43181818       0.00000000 1.0 
      0.00000000       0.45454545       0.00000000 1.0 
      0.00000000       0.47727273       0.00000000 1.0 
      0.00000000       0.50000000       0.00000000 1.0 
      0.00000000       0.50000000       0.00000000 1.0 
      0.02272727       0.50000000       0.00000000 1.0 
      0.04545455       0.50000000       0.00000000 1.0 
      0.06818182       0.50000000       0.00000000 1.0 
      0.09090909       0.50000000       0.00000000 1.0 
      0.11363636       0.50000000       0.00000000 1.0 
      0.13636364       0.50000000       0.00000000 1.0 
      0.15909091       0.50000000       0.00000000 1.0 
      0.18181818       0.50000000       0.00000000 1.0 
      0.20454545       0.50000000       0.00000000 1.0 
      0.22727273       0.50000000       0.00000000 1.0 
      0.25000000       0.50000000       0.00000000 1.0 
      0.27272727       0.50000000       0.00000000 1.0 
      0.29545455       0.50000000       0.00000000 1.0 
      0.31818182       0.50000000       0.00000000 1.0 
      0.34090909       0.50000000       0.00000000 1.0 
      0.36363636       0.50000000       0.00000000 1.0 
      0.38636364       0.50000000       0.00000000 1.0 
      0.40909091       0.50000000       0.00000000 1.0 
      0.43181818       0.50000000       0.00000000 1.0 
      0.45454545       0.50000000       0.00000000 1.0 
      0.47727273       0.50000000       0.00000000 1.0 
      0.50000000       0.50000000       0.00000000 1.0 
      0.50000000       0.50000000       0.00000000 1.0 
      0.48437500       0.48437500       0.00000000 1.0 
      0.46875000       0.46875000       0.00000000 1.0 
      0.45312500       0.45312500       0.00000000 1.0 
      0.43750000       0.43750000       0.00000000 1.0 
      0.42187500       0.42187500       0.00000000 1.0 
      0.40625000       0.40625000       0.00000000 1.0 
      0.39062500       0.39062500       0.00000000 1.0 
      0.37500000       0.37500000       0.00000000 1.0 
      0.35937500       0.35937500       0.00000000 1.0 
      0.34375000       0.34375000       0.00000000 1.0 
      0.32812500       0.32812500       0.00000000 1.0 
      0.31250000       0.31250000       0.00000000 1.0 
      0.29687500       0.29687500       0.00000000 1.0 
      0.28125000       0.28125000       0.00000000 1.0 
      0.26562500       0.26562500       0.00000000 1.0 
      0.25000000       0.25000000       0.00000000 1.0 
      0.23437500       0.23437500       0.00000000 1.0 
      0.21875000       0.21875000       0.00000000 1.0 
      0.20312500       0.20312500       0.00000000 1.0 
      0.18750000       0.18750000       0.00000000 1.0 
      0.17187500       0.17187500       0.00000000 1.0 
      0.15625000       0.15625000       0.00000000 1.0 
      0.14062500       0.14062500       0.00000000 1.0 
      0.12500000       0.12500000       0.00000000 1.0 
      0.10937500       0.10937500       0.00000000 1.0 
      0.09375000       0.09375000       0.00000000 1.0 
      0.07812500       0.07812500       0.00000000 1.0 
      0.06250000       0.06250000       0.00000000 1.0 
      0.04687500       0.04687500       0.00000000 1.0 
      0.03125000       0.03125000       0.00000000 1.0 
      0.01562500       0.01562500       0.00000000 1.0 
      0.00000000       0.00000000       0.00000000 1.0 
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      0.00000000       0.00000000       0.01351351 1.0 
      0.00000000       0.00000000       0.02702703 1.0 
      0.00000000       0.00000000       0.04054054 1.0 
      0.00000000       0.00000000       0.05405405 1.0 
      0.00000000       0.00000000       0.06756757 1.0 
      0.00000000       0.00000000       0.08108108 1.0 
      0.00000000       0.00000000       0.09459459 1.0 
      0.00000000       0.00000000       0.10810811 1.0 
     -0.00000000       0.00000000       0.12162162 1.0 
      0.00000000       0.00000000       0.13513514 1.0 
      0.00000000       0.00000000       0.14864865 1.0 
      0.00000000       0.00000000       0.16216216 1.0 
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      0.00000000       0.00000000       0.18918919 1.0 
      0.00000000       0.00000000       0.20270270 1.0 
      0.00000000       0.00000000       0.21621622 1.0 
      0.00000000       0.00000000       0.22972973 1.0 
     -0.00000000       0.00000000       0.24324324 1.0 
      0.00000000       0.00000000       0.25675676 1.0 
      0.00000000       0.00000000       0.27027027 1.0 
      0.00000000       0.00000000       0.28378378 1.0 
      0.00000000       0.00000000       0.29729730 1.0 
      0.00000000      -0.00000000       0.31081081 1.0 
      0.00000000       0.00000000       0.32432432 1.0 
      0.00000000       0.00000000       0.33783784 1.0 
      0.00000000       0.00000000       0.35135135 1.0 
      0.00000000       0.00000000       0.36486486 1.0 
      0.00000000       0.00000000       0.37837838 1.0 
      0.00000000       0.00000000       0.39189189 1.0 
      0.00000000       0.00000000       0.40540541 1.0 
      0.00000000       0.00000000       0.41891892 1.0 
      0.00000000       0.00000000       0.43243243 1.0 
      0.00000000       0.00000000       0.44594595 1.0 
      0.00000000       0.00000000       0.45945946 1.0 
      0.00000000       0.00000000       0.47297297 1.0 
     -0.00000000       0.00000000       0.48648649 1.0 
      0.00000000       0.00000000       0.50000000 1.0 
      0.00000000       0.00000000       0.50000000 1.0 
      0.00000000       0.02272727       0.50000000 1.0 
      0.00000000       0.04545455       0.50000000 1.0 
      0.00000000       0.06818182       0.50000000 1.0 
      0.00000000       0.09090909       0.50000000 1.0 
      0.00000000       0.11363636       0.50000000 1.0 
      0.00000000       0.13636364       0.50000000 1.0 
      0.00000000       0.15909091       0.50000000 1.0 
      0.00000000       0.18181818       0.50000000 1.0 
      0.00000000       0.20454545       0.50000000 1.0 
      0.00000000       0.22727273       0.50000000 1.0 
      0.00000000       0.25000000       0.50000000 1.0 
      0.00000000       0.27272727       0.50000000 1.0 
      0.00000000       0.29545455       0.50000000 1.0 
      0.00000000       0.31818182       0.50000000 1.0 
      0.00000000       0.34090909       0.50000000 1.0 
      0.00000000       0.36363636       0.50000000 1.0 
      0.00000000       0.38636364       0.50000000 1.0 
      0.00000000       0.40909091       0.50000000 1.0 
      0.00000000       0.43181818       0.50000000 1.0 
      0.00000000       0.45454545       0.50000000 1.0 
      0.00000000       0.47727273       0.50000000 1.0 
      0.00000000       0.50000000       0.50000000 1.0 
      0.00000000       0.50000000       0.50000000 1.0 
      0.02272727       0.50000000       0.50000000 1.0 
      0.04545455       0.50000000       0.50000000 1.0 
      0.06818182       0.50000000       0.50000000 1.0 
      0.09090909       0.50000000       0.50000000 1.0 
      0.11363636       0.50000000       0.50000000 1.0 
      0.13636364       0.50000000       0.50000000 1.0 
      0.15909091       0.50000000       0.50000000 1.0 
      0.18181818       0.50000000       0.50000000 1.0 
      0.20454545       0.50000000       0.50000000 1.0 
      0.22727273       0.50000000       0.50000000 1.0 
      0.25000000       0.50000000       0.50000000 1.0 
      0.27272727       0.50000000       0.50000000 1.0 
      0.29545455       0.50000000       0.50000000 1.0 
      0.31818182       0.50000000       0.50000000 1.0 
      0.34090909       0.50000000       0.50000000 1.0 
      0.36363636       0.50000000       0.50000000 1.0 
      0.38636364       0.50000000       0.50000000 1.0 
      0.40909091       0.50000000       0.50000000 1.0 
      0.43181818       0.50000000       0.50000000 1.0 
      0.45454545       0.50000000       0.50000000 1.0 
      0.47727273       0.50000000       0.50000000 1.0 
      0.50000000       0.50000000       0.50000000 1.0 
      0.50000000       0.50000000       0.50000000 1.0 
      0.48437500       0.48437500       0.50000000 1.0 
      0.46875000       0.46875000       0.50000000 1.0 
      0.45312500       0.45312500       0.50000000 1.0 
      0.43750000       0.43750000       0.50000000 1.0 
      0.42187500       0.42187500       0.50000000 1.0 
      0.40625000       0.40625000       0.50000000 1.0 
      0.39062500       0.39062500       0.50000000 1.0 
      0.37500000       0.37500000       0.50000000 1.0 
      0.35937500       0.35937500       0.50000000 1.0 
      0.34375000       0.34375000       0.50000000 1.0 
      0.32812500       0.32812500       0.50000000 1.0 
      0.31250000       0.31250000       0.50000000 1.0 
      0.29687500       0.29687500       0.50000000 1.0 
      0.28125000       0.28125000       0.50000000 1.0 
      0.26562500       0.26562500       0.50000000 1.0 
      0.25000000       0.25000000       0.50000000 1.0 
      0.23437500       0.23437500       0.50000000 1.0 
      0.21875000       0.21875000       0.50000000 1.0 
      0.20312500       0.20312500       0.50000000 1.0 
      0.18750000       0.18750000       0.50000000 1.0 
      0.17187500       0.17187500       0.50000000 1.0 
      0.15625000       0.15625000       0.50000000 1.0 
      0.14062500       0.14062500       0.50000000 1.0 
      0.12500000       0.12500000       0.50000000 1.0 
      0.10937500       0.10937500       0.50000000 1.0 
      0.09375000       0.09375000       0.50000000 1.0 
      0.07812500       0.07812500       0.50000000 1.0 
      0.06250000       0.06250000       0.50000000 1.0 
      0.04687500       0.04687500       0.50000000 1.0 
      0.03125000       0.03125000       0.50000000 1.0 
      0.01562500       0.01562500       0.50000000 1.0 
     -0.00000000      -0.00000000       0.50000000 1.0 
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      0.00000000       0.50000000       0.01351351 1.0 
      0.00000000       0.50000000       0.02702703 1.0 
      0.00000000       0.50000000       0.04054054 1.0 
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      0.00000000       0.50000000       0.06756757 1.0 
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      0.00000000       0.50000000       0.25675676 1.0 
      0.00000000       0.50000000       0.27027027 1.0 
      0.00000000       0.50000000       0.28378378 1.0 
      0.00000000       0.50000000       0.29729730 1.0 
      0.00000000       0.50000000       0.31081081 1.0 
      0.00000000       0.50000000       0.32432432 1.0 
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      0.00000000       0.50000000       0.43243243 1.0 
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      0.50000000       0.50000000       0.27027027 1.0 
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      0.50000000       0.50000000       0.47297297 1.0 
      0.50000000       0.50000000       0.48648649 1.0 
      0.50000000       0.50000000       0.50000000 1.0 

