! Pwscf input file created with ciftopw.py 
! Compound: CdMoO4
&control
         calculation     = 'bands'
         prefix          = 'CdMoO4'
         restart_mode    = 'from_scratch'
         outdir          = './'
         wf_collect      = .true.
         verbosity       = 'high'
       /
&system
         ibrav           =  14
         celldm(1)       =           12.6244123074673080
         celldm(2)       =            1.0000000000000000
         celldm(3)       =            1.0000000000000000
         celldm(4)       =           -0.7021681401374849
         celldm(5)       =           -0.7021681401374849
         celldm(6)       =            0.4043362802749700
         nat             =       12
         ntyp            =        3
         ecutwfc         =       50.00000000
         ecutrho         =      639.00000000
         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 
Cd 112.4110 Cd.rel-pbe-n-rrkjus_psl.1.0.0.UPF 
Mo  95.9400 Mo.rel-pbe-spn-rrkjus_psl.1.0.0.UPF 
ATOMIC_POSITIONS crystal
K_POINTS crystal
294
      0.00000000       0.00000000       0.00000000 1.0 
     -0.00000000      -0.00000000       0.01136364 1.0 
     -0.00000000      -0.00000000       0.02272727 1.0 
     -0.00000000      -0.00000000       0.03409091 1.0 
     -0.00000000      -0.00000000       0.04545455 1.0 
     -0.00000000      -0.00000000       0.05681818 1.0 
     -0.00000000      -0.00000000       0.06818182 1.0 
     -0.00000000      -0.00000000       0.07954545 1.0 
     -0.00000000      -0.00000000       0.09090909 1.0 
     -0.00000000      -0.00000000       0.10227273 1.0 
     -0.00000000      -0.00000000       0.11363636 1.0 
     -0.00000000      -0.00000000       0.12500000 1.0 
     -0.00000000      -0.00000000       0.13636364 1.0 
     -0.00000000      -0.00000000       0.14772727 1.0 
     -0.00000000      -0.00000000       0.15909091 1.0 
     -0.00000000      -0.00000000       0.17045455 1.0 
     -0.00000000      -0.00000000       0.18181818 1.0 
     -0.00000000      -0.00000000       0.19318182 1.0 
     -0.00000000      -0.00000000       0.20454545 1.0 
     -0.00000000       0.00000000       0.21590909 1.0 
     -0.00000000      -0.00000000       0.22727273 1.0 
     -0.00000000      -0.00000000       0.23863636 1.0 
     -0.00000000      -0.00000000       0.25000000 1.0 
     -0.00000000      -0.00000000       0.26136364 1.0 
     -0.00000000      -0.00000000       0.27272727 1.0 
     -0.00000000       0.00000000       0.28409091 1.0 
     -0.00000000      -0.00000000       0.29545455 1.0 
     -0.00000000      -0.00000000       0.30681818 1.0 
     -0.00000000      -0.00000000       0.31818182 1.0 
     -0.00000000      -0.00000000       0.32954545 1.0 
     -0.00000000      -0.00000000       0.34090909 1.0 
     -0.00000000      -0.00000000       0.35227273 1.0 
     -0.00000000      -0.00000000       0.36363636 1.0 
     -0.00000000      -0.00000000       0.37500000 1.0 
     -0.00000000      -0.00000000       0.38636364 1.0 
     -0.00000000      -0.00000000       0.39772727 1.0 
     -0.00000000      -0.00000000       0.40909091 1.0 
     -0.00000000      -0.00000000       0.42045455 1.0 
     -0.00000000       0.00000000       0.43181818 1.0 
     -0.00000000      -0.00000000       0.44318182 1.0 
     -0.00000000      -0.00000000       0.45454545 1.0 
     -0.00000000      -0.00000000       0.46590909 1.0 
     -0.00000000      -0.00000000       0.47727273 1.0 
     -0.00000000       0.00000000       0.48863636 1.0 
     -0.00000000      -0.00000000       0.50000000 1.0 
     -0.00000000      -0.00000000       0.50000000 1.0 
     -0.01060401       0.01060401       0.50000000 1.0 
     -0.02120802       0.02120802       0.50000000 1.0 
     -0.03181202       0.03181202       0.50000000 1.0 
     -0.04241603       0.04241603       0.50000000 1.0 
     -0.05302004       0.05302004       0.50000000 1.0 
     -0.06362405       0.06362405       0.50000000 1.0 
     -0.07422806       0.07422806       0.50000000 1.0 
     -0.08483206       0.08483206       0.50000000 1.0 
     -0.09543607       0.09543607       0.50000000 1.0 
     -0.10604008       0.10604008       0.50000000 1.0 
     -0.10604008       0.10604008       0.50000000 1.0 
     -0.11391928       0.11391928       0.49212080 1.0 
     -0.12179848       0.12179848       0.48424160 1.0 
     -0.12967767       0.12967767       0.47636240 1.0 
     -0.13755687       0.13755687       0.46848321 1.0 
     -0.14543607       0.14543607       0.46060401 1.0 
     -0.15331527       0.15331527       0.45272481 1.0 
     -0.16119447       0.16119447       0.44484561 1.0 
     -0.16907367       0.16907367       0.43696641 1.0 
     -0.17695286       0.17695286       0.42908721 1.0 
     -0.18483206       0.18483206       0.42120802 1.0 
     -0.19271126       0.19271126       0.41332882 1.0 
     -0.20059046       0.20059046       0.40544962 1.0 
     -0.20846966       0.20846966       0.39757042 1.0 
     -0.21634886       0.21634886       0.38969122 1.0 
     -0.22422806       0.22422806       0.38181202 1.0 
     -0.23210725       0.23210725       0.37393283 1.0 
     -0.23998645       0.23998645       0.36605363 1.0 
     -0.24786565       0.24786565       0.35817443 1.0 
     -0.25574485       0.25574485       0.35029523 1.0 
     -0.26362405       0.26362405       0.34241603 1.0 
     -0.27150325       0.27150325       0.33453683 1.0 
     -0.27938244       0.27938244       0.32665763 1.0 
     -0.28726164       0.28726164       0.31877844 1.0 
     -0.29514084       0.29514084       0.31089924 1.0 
     -0.30302004       0.30302004       0.30302004 1.0 
     -0.30302004       0.30302004       0.30302004 1.0 
     -0.29483031       0.29483031       0.29483031 1.0 
     -0.28664058       0.28664058       0.28664058 1.0 
     -0.27845085       0.27845085       0.27845085 1.0 
     -0.27026112       0.27026112       0.27026112 1.0 
     -0.26207139       0.26207139       0.26207139 1.0 
     -0.25388165       0.25388165       0.25388165 1.0 
     -0.24569192       0.24569192       0.24569192 1.0 
     -0.23750219       0.23750219       0.23750219 1.0 
     -0.22931246       0.22931246       0.22931246 1.0 
     -0.22112273       0.22112273       0.22112273 1.0 
     -0.21293300       0.21293300       0.21293300 1.0 
     -0.20474327       0.20474327       0.20474327 1.0 
     -0.19655354       0.19655354       0.19655354 1.0 
     -0.18836381       0.18836381       0.18836381 1.0 
     -0.18017408       0.18017408       0.18017408 1.0 
     -0.17198435       0.17198435       0.17198435 1.0 
     -0.16379462       0.16379462       0.16379462 1.0 
     -0.15560489       0.15560489       0.15560489 1.0 
     -0.14741515       0.14741515       0.14741515 1.0 
     -0.13922542       0.13922542       0.13922542 1.0 
     -0.13103569       0.13103569       0.13103569 1.0 
     -0.12284596       0.12284596       0.12284596 1.0 
     -0.11465623       0.11465623       0.11465623 1.0 
     -0.10646650       0.10646650       0.10646650 1.0 
     -0.09827677       0.09827677       0.09827677 1.0 
     -0.09008704       0.09008704       0.09008704 1.0 
     -0.08189731       0.08189731       0.08189731 1.0 
     -0.07370758       0.07370758       0.07370758 1.0 
     -0.06551785       0.06551785       0.06551785 1.0 
     -0.05732812       0.05732812       0.05732812 1.0 
     -0.04913838       0.04913838       0.04913838 1.0 
     -0.04094865       0.04094865       0.04094865 1.0 
     -0.03275892       0.03275892       0.03275892 1.0 
     -0.02456919       0.02456919       0.02456919 1.0 
     -0.01637946       0.01637946       0.01637946 1.0 
     -0.00818973       0.00818973       0.00818973 1.0 
      0.00000000       0.00000000       0.00000000 1.0 
      0.00000000       0.00000000       0.00000000 1.0 
      0.01724138       0.01724138      -0.01724138 1.0 
      0.03448276       0.03448276      -0.03448276 1.0 
      0.05172414       0.05172414      -0.05172414 1.0 
      0.06896552       0.06896552      -0.06896552 1.0 
      0.08620690       0.08620690      -0.08620690 1.0 
      0.10344828       0.10344828      -0.10344828 1.0 
      0.12068966       0.12068966      -0.12068966 1.0 
      0.13793103       0.13793103      -0.13793103 1.0 
      0.15517241       0.15517241      -0.15517241 1.0 
      0.17241379       0.17241379      -0.17241379 1.0 
      0.18965517       0.18965517      -0.18965517 1.0 
      0.20689655       0.20689655      -0.20689655 1.0 
      0.22413793       0.22413793      -0.22413793 1.0 
      0.24137931       0.24137931      -0.24137931 1.0 
      0.25862069       0.25862069      -0.25862069 1.0 
      0.27586207       0.27586207      -0.27586207 1.0 
      0.29310345       0.29310345      -0.29310345 1.0 
      0.31034483       0.31034483      -0.31034483 1.0 
      0.32758621       0.32758621      -0.32758621 1.0 
      0.34482759       0.34482759      -0.34482759 1.0 
      0.36206897       0.36206897      -0.36206897 1.0 
      0.37931034       0.37931034      -0.37931034 1.0 
      0.39655172       0.39655172      -0.39655172 1.0 
      0.41379310       0.41379310      -0.41379310 1.0 
      0.43103448       0.43103448      -0.43103448 1.0 
      0.44827586       0.44827586      -0.44827586 1.0 
      0.46551724       0.46551724      -0.46551724 1.0 
      0.48275862       0.48275862      -0.48275862 1.0 
      0.50000000       0.50000000      -0.50000000 1.0 
      0.50000000       0.50000000      -0.50000000 1.0 
      0.49212080       0.50787920      -0.49212080 1.0 
      0.48424160       0.51575840      -0.48424160 1.0 
      0.47636240       0.52363760      -0.47636240 1.0 
      0.46848321       0.53151679      -0.46848321 1.0 
      0.46060401       0.53939599      -0.46060401 1.0 
      0.45272481       0.54727519      -0.45272481 1.0 
      0.44484561       0.55515439      -0.44484561 1.0 
      0.43696641       0.56303359      -0.43696641 1.0 
      0.42908721       0.57091279      -0.42908721 1.0 
      0.42120802       0.57879198      -0.42120802 1.0 
      0.41332882       0.58667118      -0.41332882 1.0 
      0.40544962       0.59455038      -0.40544962 1.0 
      0.39757042       0.60242958      -0.39757042 1.0 
      0.38969122       0.61030878      -0.38969122 1.0 
      0.38181202       0.61818798      -0.38181202 1.0 
      0.37393283       0.62606717      -0.37393283 1.0 
      0.36605363       0.63394637      -0.36605363 1.0 
      0.35817443       0.64182557      -0.35817443 1.0 
      0.35029523       0.64970477      -0.35029523 1.0 
      0.34241603       0.65758397      -0.34241603 1.0 
      0.33453683       0.66546317      -0.33453683 1.0 
      0.32665763       0.67334237      -0.32665763 1.0 
      0.31877844       0.68122156      -0.31877844 1.0 
      0.31089924       0.68910076      -0.31089924 1.0 
      0.30302004       0.69697996      -0.30302004 1.0 
      0.30302004       0.69697996      -0.30302004 1.0 
      0.28408129       0.68466871      -0.28408129 1.0 
      0.26514253       0.67235747      -0.26514253 1.0 
      0.24620378       0.66004622      -0.24620378 1.0 
      0.22726503       0.64773497      -0.22726503 1.0 
      0.20832628       0.63542372      -0.20832628 1.0 
      0.18938752       0.62311248      -0.18938752 1.0 
      0.17044877       0.61080123      -0.17044877 1.0 
      0.15151002       0.59848998      -0.15151002 1.0 
      0.13257127       0.58617873      -0.13257127 1.0 
      0.11363251       0.57386749      -0.11363251 1.0 
      0.09469376       0.56155624      -0.09469376 1.0 
      0.07575501       0.54924499      -0.07575501 1.0 
      0.05681626       0.53693374      -0.05681626 1.0 
      0.03787750       0.52462250      -0.03787750 1.0 
      0.01893875       0.51231125      -0.01893875 1.0 
      0.00000000       0.50000000       0.00000000 1.0 
      0.00000000       0.50000000       0.00000000 1.0 
      0.00806452       0.49193548       0.00806452 1.0 
      0.01612903       0.48387097       0.01612903 1.0 
      0.02419355       0.47580645       0.02419355 1.0 
      0.03225806       0.46774194       0.03225806 1.0 
      0.04032258       0.45967742       0.04032258 1.0 
      0.04838710       0.45161290       0.04838710 1.0 
      0.05645161       0.44354839       0.05645161 1.0 
      0.06451613       0.43548387       0.06451613 1.0 
      0.07258065       0.42741935       0.07258065 1.0 
      0.08064516       0.41935484       0.08064516 1.0 
      0.08870968       0.41129032       0.08870968 1.0 
      0.09677419       0.40322581       0.09677419 1.0 
      0.10483871       0.39516129       0.10483871 1.0 
      0.11290323       0.38709677       0.11290323 1.0 
      0.12096774       0.37903226       0.12096774 1.0 
      0.12903226       0.37096774       0.12903226 1.0 
      0.13709677       0.36290323       0.13709677 1.0 
      0.14516129       0.35483871       0.14516129 1.0 
      0.15322581       0.34677419       0.15322581 1.0 
      0.16129032       0.33870968       0.16129032 1.0 
      0.16935484       0.33064516       0.16935484 1.0 
      0.17741935       0.32258065       0.17741935 1.0 
      0.18548387       0.31451613       0.18548387 1.0 
      0.19354839       0.30645161       0.19354839 1.0 
      0.20161290       0.29838710       0.20161290 1.0 
      0.20967742       0.29032258       0.20967742 1.0 
      0.21774194       0.28225806       0.21774194 1.0 
      0.22580645       0.27419355       0.22580645 1.0 
      0.23387097       0.26612903       0.23387097 1.0 
      0.24193548       0.25806452       0.24193548 1.0 
      0.25000000       0.25000000       0.25000000 1.0 
      0.25000000       0.25000000       0.25000000 1.0 
      0.26470588       0.26470588       0.22905647 1.0 
      0.27941176       0.27941176       0.20811293 1.0 
      0.29411765       0.29411765       0.18716940 1.0 
      0.30882353       0.30882353       0.16622586 1.0 
      0.32352941       0.32352941       0.14528233 1.0 
      0.33823529       0.33823529       0.12433880 1.0 
      0.35294118       0.35294118       0.10339526 1.0 
      0.36764706       0.36764706       0.08245173 1.0 
      0.38235294       0.38235294       0.06150819 1.0 
      0.39705882       0.39705882       0.04056466 1.0 
      0.41176471       0.41176471       0.01962113 1.0 
      0.42647059       0.42647059      -0.00132241 1.0 
      0.44117647       0.44117647      -0.02226594 1.0 
      0.45588235       0.45588235      -0.04320948 1.0 
      0.47058824       0.47058824      -0.06415301 1.0 
      0.48529412       0.48529412      -0.08509654 1.0 
      0.50000000       0.50000000      -0.10604008 1.0 
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      0.50000000       0.50000000      -0.14080125 1.0 
      0.50000000       0.50000000      -0.15238830 1.0 
      0.50000000       0.50000000      -0.16397536 1.0 
      0.50000000       0.50000000      -0.17556242 1.0 
      0.50000000       0.50000000      -0.18714947 1.0 
      0.50000000       0.50000000      -0.19873653 1.0 
      0.50000000       0.50000000      -0.21032359 1.0 
      0.50000000       0.50000000      -0.22191064 1.0 
      0.50000000       0.50000000      -0.23349770 1.0 
      0.50000000       0.50000000      -0.24508476 1.0 
      0.50000000       0.50000000      -0.25667181 1.0 
      0.50000000       0.50000000      -0.26825887 1.0 
      0.50000000       0.50000000      -0.27984593 1.0 
      0.50000000       0.50000000      -0.29143298 1.0 
      0.50000000       0.50000000      -0.30302004 1.0 
      0.50000000       0.50000000      -0.31460710 1.0 
      0.50000000       0.50000000      -0.32619415 1.0 
      0.50000000       0.50000000      -0.33778121 1.0 
      0.50000000       0.50000000      -0.34936827 1.0 
      0.50000000       0.50000000      -0.36095532 1.0 
      0.50000000       0.50000000      -0.37254238 1.0 
      0.50000000       0.50000000      -0.38412943 1.0 
      0.50000000       0.50000000      -0.39571649 1.0 
      0.50000000       0.50000000      -0.40730355 1.0 
      0.50000000       0.50000000      -0.41889060 1.0 
      0.50000000       0.50000000      -0.43047766 1.0 
      0.50000000       0.50000000      -0.44206472 1.0 
      0.50000000       0.50000000      -0.45365177 1.0 
      0.50000000       0.50000000      -0.46523883 1.0 
      0.50000000       0.50000000      -0.47682589 1.0 
      0.50000000       0.50000000      -0.48841294 1.0 
      0.50000000       0.50000000      -0.50000000 1.0 
     -0.00000000      -0.00000000       0.50000000 1.0 
      0.01666667       0.01666667       0.48333333 1.0 
      0.03333333       0.03333333       0.46666667 1.0 
      0.05000000       0.05000000       0.45000000 1.0 
      0.06666667       0.06666667       0.43333333 1.0 
      0.08333333       0.08333333       0.41666667 1.0 
      0.10000000       0.10000000       0.40000000 1.0 
      0.11666667       0.11666667       0.38333333 1.0 
      0.13333333       0.13333333       0.36666667 1.0 
      0.15000000       0.15000000       0.35000000 1.0 
      0.16666667       0.16666667       0.33333333 1.0 
      0.18333333       0.18333333       0.31666667 1.0 
      0.20000000       0.20000000       0.30000000 1.0 
      0.21666667       0.21666667       0.28333333 1.0 
      0.23333333       0.23333333       0.26666667 1.0 
      0.25000000       0.25000000       0.25000000 1.0 

