! Pwscf input file created with ciftopw.py 
! Compound: K4HgAs2
&control
         calculation     = 'bands'
         prefix          = 'K4HgAs2'
         restart_mode    = 'from_scratch'
         outdir          = './'
         wf_collect      = .true.
         verbosity       = 'high'
       /
&system
         ibrav           =  14
         celldm(1)       =           18.5444182104056523
         celldm(2)       =            1.0000000000000000
         celldm(3)       =            1.0000000000000000
         celldm(4)       =            0.8275598112646235
         celldm(5)       =            0.8275598112646235
         celldm(6)       =            0.8275598112646235
         nat             =        7
         ntyp            =        3
         ecutwfc         =       43.00000000
         ecutrho         =      416.00000000
         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
Hg 200.5900 Hg.rel-pbe-n-rrkjus_psl.1.0.0.UPF 
As  74.9216 As.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
218
      0.00000000       0.00000000       0.00000000 1.0 
      0.01562500       0.00000000       0.00000000 1.0 
      0.03125000       0.00000000       0.00000000 1.0 
      0.04687500       0.00000000       0.00000000 1.0 
      0.06250000       0.00000000       0.00000000 1.0 
      0.07812500       0.00000000       0.00000000 1.0 
      0.09375000       0.00000000       0.00000000 1.0 
      0.10937500       0.00000000       0.00000000 1.0 
      0.12500000       0.00000000       0.00000000 1.0 
      0.14062500       0.00000000       0.00000000 1.0 
      0.15625000       0.00000000       0.00000000 1.0 
      0.17187500       0.00000000       0.00000000 1.0 
      0.18750000       0.00000000       0.00000000 1.0 
      0.20312500       0.00000000       0.00000000 1.0 
      0.21875000       0.00000000       0.00000000 1.0 
      0.23437500       0.00000000       0.00000000 1.0 
      0.25000000       0.00000000       0.00000000 1.0 
      0.26562500       0.00000000       0.00000000 1.0 
      0.28125000       0.00000000       0.00000000 1.0 
      0.29687500       0.00000000       0.00000000 1.0 
      0.31250000       0.00000000       0.00000000 1.0 
      0.32812500       0.00000000       0.00000000 1.0 
      0.34375000       0.00000000       0.00000000 1.0 
      0.35937500       0.00000000       0.00000000 1.0 
      0.37500000       0.00000000       0.00000000 1.0 
      0.39062500       0.00000000       0.00000000 1.0 
      0.40625000       0.00000000       0.00000000 1.0 
      0.42187500       0.00000000       0.00000000 1.0 
      0.43750000       0.00000000       0.00000000 1.0 
      0.45312500       0.00000000       0.00000000 1.0 
      0.46875000       0.00000000       0.00000000 1.0 
      0.48437500       0.00000000       0.00000000 1.0 
      0.50000000       0.00000000       0.00000000 1.0 
      0.50000000       0.00000000       0.00000000 1.0 
      0.50000000       0.00896740      -0.00896740 1.0 
      0.50000000       0.01793480      -0.01793480 1.0 
      0.50000000       0.02690220      -0.02690220 1.0 
      0.50000000       0.03586961      -0.03586961 1.0 
      0.50000000       0.04483701      -0.04483701 1.0 
      0.50000000       0.05380441      -0.05380441 1.0 
      0.50000000       0.06277181      -0.06277181 1.0 
      0.50000000       0.07173921      -0.07173921 1.0 
      0.50000000       0.08070661      -0.08070661 1.0 
      0.50000000       0.08967402      -0.08967402 1.0 
      0.50000000       0.09864142      -0.09864142 1.0 
      0.50000000       0.10760882      -0.10760882 1.0 
      0.50000000       0.11657622      -0.11657622 1.0 
      0.50000000       0.12554362      -0.12554362 1.0 
      0.50000000       0.13451102      -0.13451102 1.0 
      0.50000000       0.14347842      -0.14347842 1.0 
      0.50000000       0.15244583      -0.15244583 1.0 
      0.50000000       0.16141323      -0.16141323 1.0 
      0.50000000       0.17038063      -0.17038063 1.0 
      0.50000000       0.17934803      -0.17934803 1.0 
      0.50000000       0.18831543      -0.18831543 1.0 
      0.81168457       0.50000000       0.18831543 1.0 
      0.80251737       0.50000000       0.19748263 1.0 
      0.79335018       0.50000000       0.20664982 1.0 
      0.78418299       0.50000000       0.21581701 1.0 
      0.77501579       0.50000000       0.22498421 1.0 
      0.76584860       0.50000000       0.23415140 1.0 
      0.75668141       0.50000000       0.24331859 1.0 
      0.74751422       0.50000000       0.25248578 1.0 
      0.73834702       0.50000000       0.26165298 1.0 
      0.72917983       0.50000000       0.27082017 1.0 
      0.72001264       0.50000000       0.27998736 1.0 
      0.71084544       0.50000000       0.28915456 1.0 
      0.70167825       0.50000000       0.29832175 1.0 
      0.69251106       0.50000000       0.30748894 1.0 
      0.68334386       0.50000000       0.31665614 1.0 
      0.67417667       0.50000000       0.32582333 1.0 
      0.66500948       0.50000000       0.33499052 1.0 
      0.65584228       0.50000000       0.34415772 1.0 
      0.64667509       0.50000000       0.35332491 1.0 
      0.63750790       0.50000000       0.36249210 1.0 
      0.62834070       0.50000000       0.37165930 1.0 
      0.61917351       0.50000000       0.38082649 1.0 
      0.61000632       0.50000000       0.38999368 1.0 
      0.60083912       0.50000000       0.39916088 1.0 
      0.59167193       0.50000000       0.40832807 1.0 
      0.58250474       0.50000000       0.41749526 1.0 
      0.57333755       0.50000000       0.42666245 1.0 
      0.56417035       0.50000000       0.43582965 1.0 
      0.55500316       0.50000000       0.44499684 1.0 
      0.54583597       0.50000000       0.45416403 1.0 
      0.53666877       0.50000000       0.46333123 1.0 
      0.52750158       0.50000000       0.47249842 1.0 
      0.51833439       0.50000000       0.48166561 1.0 
      0.50916719       0.50000000       0.49083281 1.0 
      0.50000000       0.50000000       0.50000000 1.0 
      0.50000000       0.50000000       0.50000000 1.0 
      0.47222222       0.47222222       0.47222222 1.0 
      0.44444444       0.44444444       0.44444444 1.0 
      0.41666667       0.41666667       0.41666667 1.0 
      0.38888889       0.38888889       0.38888889 1.0 
      0.36111111       0.36111111       0.36111111 1.0 
      0.33333333       0.33333333       0.33333333 1.0 
      0.30555556       0.30555556       0.30555556 1.0 
      0.27777778       0.27777778       0.27777778 1.0 
      0.25000000       0.25000000       0.25000000 1.0 
      0.22222222       0.22222222       0.22222222 1.0 
      0.19444444       0.19444444       0.19444444 1.0 
      0.16666667       0.16666667       0.16666667 1.0 
      0.13888889       0.13888889       0.13888889 1.0 
      0.11111111       0.11111111       0.11111111 1.0 
      0.08333333       0.08333333       0.08333333 1.0 
      0.05555556       0.05555556       0.05555556 1.0 
      0.02777778       0.02777778       0.02777778 1.0 
      0.00000000       0.00000000       0.00000000 1.0 
      0.00000000       0.00000000       0.00000000 1.0 
      0.00905678       0.00000000      -0.00905678 1.0 
      0.01811356       0.00000000      -0.01811356 1.0 
      0.02717035       0.00000000      -0.02717035 1.0 
      0.03622713       0.00000000      -0.03622713 1.0 
      0.04528391       0.00000000      -0.04528391 1.0 
      0.05434069       0.00000000      -0.05434069 1.0 
      0.06339747       0.00000000      -0.06339747 1.0 
      0.07245426       0.00000000      -0.07245426 1.0 
      0.08151104       0.00000000      -0.08151104 1.0 
      0.09056782       0.00000000      -0.09056782 1.0 
      0.09962460       0.00000000      -0.09962460 1.0 
      0.10868138       0.00000000      -0.10868138 1.0 
      0.11773817       0.00000000      -0.11773817 1.0 
      0.12679495       0.00000000      -0.12679495 1.0 
      0.13585173       0.00000000      -0.13585173 1.0 
      0.14490851       0.00000000      -0.14490851 1.0 
      0.15396529       0.00000000      -0.15396529 1.0 
      0.16302208       0.00000000      -0.16302208 1.0 
      0.17207886       0.00000000      -0.17207886 1.0 
      0.18113564       0.00000000      -0.18113564 1.0 
      0.19019242       0.00000000      -0.19019242 1.0 
      0.19924920       0.00000000      -0.19924920 1.0 
      0.20830599       0.00000000      -0.20830599 1.0 
      0.21736277       0.00000000      -0.21736277 1.0 
      0.22641955       0.00000000      -0.22641955 1.0 
      0.23547633       0.00000000      -0.23547633 1.0 
      0.24453311       0.00000000      -0.24453311 1.0 
      0.25358990       0.00000000      -0.25358990 1.0 
      0.26264668       0.00000000      -0.26264668 1.0 
      0.27170346       0.00000000      -0.27170346 1.0 
      0.28076024       0.00000000      -0.28076024 1.0 
      0.28981702       0.00000000      -0.28981702 1.0 
      0.29887381       0.00000000      -0.29887381 1.0 
      0.30793059       0.00000000      -0.30793059 1.0 
      0.31698737       0.00000000      -0.31698737 1.0 
      0.32604415       0.00000000      -0.32604415 1.0 
      0.33510093       0.00000000      -0.33510093 1.0 
      0.34415772       0.00000000      -0.34415772 1.0 
      0.65584228       0.34415772       0.00000000 1.0 
      0.64667509       0.35332491       0.00000000 1.0 
      0.63750790       0.36249210       0.00000000 1.0 
      0.62834070       0.37165930       0.00000000 1.0 
      0.61917351       0.38082649       0.00000000 1.0 
      0.61000632       0.38999368       0.00000000 1.0 
      0.60083912       0.39916088       0.00000000 1.0 
      0.59167193       0.40832807       0.00000000 1.0 
      0.58250474       0.41749526       0.00000000 1.0 
      0.57333755       0.42666245       0.00000000 1.0 
      0.56417035       0.43582965       0.00000000 1.0 
      0.55500316       0.44499684       0.00000000 1.0 
      0.54583597       0.45416403       0.00000000 1.0 
      0.53666877       0.46333123       0.00000000 1.0 
      0.52750158       0.47249842       0.00000000 1.0 
      0.51833439       0.48166561       0.00000000 1.0 
      0.50916719       0.49083281       0.00000000 1.0 
      0.50000000       0.50000000       0.00000000 1.0 
      0.50000000       0.50000000       0.00000000 1.0 
      0.52226318       0.52226318       0.02690220 1.0 
      0.54452637       0.54452637       0.05380441 1.0 
      0.56678955       0.56678955       0.08070661 1.0 
      0.58905273       0.58905273       0.10760882 1.0 
      0.61131592       0.61131592       0.13451102 1.0 
      0.63357910       0.63357910       0.16141323 1.0 
      0.65584228       0.65584228       0.18831543 1.0 
      0.65584228       0.65584228       0.18831543 1.0 
      0.65064754       0.65064754       0.19870492 1.0 
      0.64545280       0.64545280       0.20909440 1.0 
      0.64025806       0.64025806       0.21948389 1.0 
      0.63506331       0.63506331       0.22987337 1.0 
      0.62986857       0.62986857       0.24026286 1.0 
      0.62467383       0.62467383       0.25065235 1.0 
      0.61947908       0.61947908       0.26104183 1.0 
      0.61428434       0.61428434       0.27143132 1.0 
      0.60908960       0.60908960       0.28182080 1.0 
      0.60389486       0.60389486       0.29221029 1.0 
      0.59870011       0.59870011       0.30259977 1.0 
      0.59350537       0.59350537       0.31298926 1.0 
      0.58831063       0.58831063       0.32337875 1.0 
      0.58311588       0.58311588       0.33376823 1.0 
      0.57792114       0.57792114       0.34415772 1.0 
      0.57272640       0.57272640       0.35454720 1.0 
      0.56753166       0.56753166       0.36493669 1.0 
      0.56233691       0.56233691       0.37532617 1.0 
      0.55714217       0.55714217       0.38571566 1.0 
      0.55194743       0.55194743       0.39610514 1.0 
      0.54675269       0.54675269       0.40649463 1.0 
      0.54155794       0.54155794       0.41688412 1.0 
      0.53636320       0.53636320       0.42727360 1.0 
      0.53116846       0.53116846       0.43766309 1.0 
      0.52597371       0.52597371       0.44805257 1.0 
      0.52077897       0.52077897       0.45844206 1.0 
      0.51558423       0.51558423       0.46883154 1.0 
      0.51038949       0.51038949       0.47922103 1.0 
      0.50519474       0.50519474       0.48961051 1.0 
      0.50000000       0.50000000       0.50000000 1.0 
      0.50000000       0.00000000       0.00000000 1.0 
      0.52597371       0.02867981       0.02867981 1.0 
      0.55194743       0.05735962       0.05735962 1.0 
      0.57792114       0.08603943       0.08603943 1.0 
      0.60389486       0.11471924       0.11471924 1.0 
      0.62986857       0.14339905       0.14339905 1.0 
      0.65584228       0.17207886       0.17207886 1.0 
      0.68181600       0.20075867       0.20075867 1.0 
      0.70778971       0.22943848       0.22943848 1.0 
      0.73376343       0.25811829       0.25811829 1.0 
      0.75973714       0.28679810       0.28679810 1.0 
      0.78571085       0.31547791       0.31547791 1.0 
      0.81168457       0.34415772       0.34415772 1.0 

