! Pwscf input file created with ciftopw.py 
! Compound: NaTaGeO5
&control
         calculation     = 'bands'
         prefix          = 'NaTaGeO5'
         restart_mode    = 'from_scratch'
         outdir          = './'
         wf_collect      = .true.
         verbosity       = 'high'
       /
&system
         ibrav           =  14
         celldm(1)       =           10.6386624282730189
         celldm(2)       =            1.0000000000000000
         celldm(3)       =            1.3176456609007707
         celldm(4)       =            0.2558930291185968
         celldm(5)       =            0.2558930291185968
         celldm(6)       =           -0.2588914580349147
         nat             =       16
         ntyp            =        4
         ecutwfc         =       67.00000000
         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
Ge  72.6400 Ge.rel-pbe-n-rrkjus_psl.1.0.0.UPF 
 O  15.9994 O.rel-pbe-n-rrkjus_psl.1.0.0.UPF 
Na  22.9898 Na.rel-pbe-spnl-rrkjus_psl.1.0.0.UPF 
Ta 180.9479 Ta.rel-pbe-spn-rrkjus_psl.1.0.0.UPF 
ATOMIC_POSITIONS crystal
K_POINTS crystal
289
      0.00000000       0.00000000       0.00000000 1.0 
      0.01045197       0.01045197       0.00352416 1.0 
      0.02090394       0.02090394       0.00704831 1.0 
      0.03135591       0.03135591       0.01057247 1.0 
      0.04180788       0.04180788       0.01409663 1.0 
      0.05225985       0.05225985       0.01762078 1.0 
      0.06271182       0.06271182       0.02114494 1.0 
      0.07316378       0.07316378       0.02466910 1.0 
      0.08361575       0.08361575       0.02819325 1.0 
      0.09406772       0.09406772       0.03171741 1.0 
      0.10451969       0.10451969       0.03524157 1.0 
      0.11497166       0.11497166       0.03876572 1.0 
      0.12542363       0.12542363       0.04228988 1.0 
      0.13587560       0.13587560       0.04581404 1.0 
      0.14632757       0.14632757       0.04933819 1.0 
      0.15677954       0.15677954       0.05286235 1.0 
      0.16723151       0.16723151       0.05638651 1.0 
      0.17768348       0.17768348       0.05991066 1.0 
      0.18813545       0.18813545       0.06343482 1.0 
      0.19858741       0.19858741       0.06695898 1.0 
      0.20903938       0.20903938       0.07048313 1.0 
      0.21949135       0.21949135       0.07400729 1.0 
      0.22994332       0.22994332       0.07753145 1.0 
      0.24039529       0.24039529       0.08105560 1.0 
      0.25084726       0.25084726       0.08457976 1.0 
      0.26129923       0.26129923       0.08810392 1.0 
      0.27175120       0.27175120       0.09162807 1.0 
      0.28220317       0.28220317       0.09515223 1.0 
      0.29265514       0.29265514       0.09867639 1.0 
      0.30310711       0.30310711       0.10220054 1.0 
      0.31355908       0.31355908       0.10572470 1.0 
      0.32401104       0.32401104       0.10924886 1.0 
      0.33446301       0.33446301       0.11277301 1.0 
      0.34491498       0.34491498       0.11629717 1.0 
      0.35536695       0.35536695       0.11982133 1.0 
      0.36581892       0.36581892       0.12334548 1.0 
      0.37627089       0.37627089       0.12686964 1.0 
      0.38672286       0.38672286       0.13039380 1.0 
      0.39717483       0.39717483       0.13391796 1.0 
      0.39717483       0.39717483       0.13391796 1.0 
      0.40146045       0.40146045       0.15598547 1.0 
      0.40574606       0.40574606       0.17805298 1.0 
      0.41003168       0.41003168       0.20012050 1.0 
      0.41431729       0.41431729       0.22218801 1.0 
      0.41860291       0.41860291       0.24425553 1.0 
      0.42288852       0.42288852       0.26632304 1.0 
      0.42717414       0.42717414       0.28839055 1.0 
      0.43145976       0.43145976       0.31045807 1.0 
      0.43574537       0.43574537       0.33252558 1.0 
      0.44003099       0.44003099       0.35459310 1.0 
      0.44431660       0.44431660       0.37666061 1.0 
      0.44860222       0.44860222       0.39872812 1.0 
      0.45288783       0.45288783       0.42079564 1.0 
      0.45717345       0.45717345       0.44286315 1.0 
      0.46145907       0.46145907       0.46493067 1.0 
      0.46145907       0.46145907       0.46493067 1.0 
      0.45631633       0.45631633       0.47844965 1.0 
      0.45117359       0.45117359       0.49196863 1.0 
      0.44603085       0.44603085       0.50548762 1.0 
      0.44088811       0.44088811       0.51900660 1.0 
      0.43574537       0.43574537       0.53252558 1.0 
      0.43060263       0.43060263       0.54604457 1.0 
      0.42545989       0.42545989       0.55956355 1.0 
      0.42031715       0.42031715       0.57308253 1.0 
      0.41517442       0.41517442       0.58660151 1.0 
      0.41003168       0.41003168       0.60012050 1.0 
      0.40488894       0.40488894       0.61363948 1.0 
      0.39974620       0.39974620       0.62715846 1.0 
      0.39460346       0.39460346       0.64067745 1.0 
      0.38946072       0.38946072       0.65419643 1.0 
      0.38431798       0.38431798       0.66771541 1.0 
      0.37917524       0.37917524       0.68123440 1.0 
      0.37403250       0.37403250       0.69475338 1.0 
      0.36888977       0.36888977       0.70827236 1.0 
      0.36374703       0.36374703       0.72179134 1.0 
      0.35860429       0.35860429       0.73531033 1.0 
      0.35346155       0.35346155       0.74882931 1.0 
      0.34831881       0.34831881       0.76234829 1.0 
      0.34317607       0.34317607       0.77586728 1.0 
      0.33803333       0.33803333       0.78938626 1.0 
      0.33289059       0.33289059       0.80290524 1.0 
      0.33289059       0.33289059       0.80290524 1.0 
      0.32215219       0.32215219       0.79313411 1.0 
      0.31141378       0.31141378       0.78336297 1.0 
      0.30067537       0.30067537       0.77359183 1.0 
      0.28993697       0.28993697       0.76382070 1.0 
      0.27919856       0.27919856       0.75404956 1.0 
      0.26846016       0.26846016       0.74427842 1.0 
      0.25772175       0.25772175       0.73450728 1.0 
      0.24698334       0.24698334       0.72473615 1.0 
      0.23624494       0.23624494       0.71496501 1.0 
      0.22550653       0.22550653       0.70519387 1.0 
      0.21476812       0.21476812       0.69542274 1.0 
      0.20402972       0.20402972       0.68565160 1.0 
      0.19329131       0.19329131       0.67588046 1.0 
      0.18255291       0.18255291       0.66610933 1.0 
      0.17181450       0.17181450       0.65633819 1.0 
      0.16107609       0.16107609       0.64656705 1.0 
      0.15033769       0.15033769       0.63679592 1.0 
      0.13959928       0.13959928       0.62702478 1.0 
      0.12886087       0.12886087       0.61725364 1.0 
      0.11812247       0.11812247       0.60748251 1.0 
      0.10738406       0.10738406       0.59771137 1.0 
      0.09664566       0.09664566       0.58794023 1.0 
      0.08590725       0.08590725       0.57816909 1.0 
      0.07516884       0.07516884       0.56839796 1.0 
      0.06443044       0.06443044       0.55862682 1.0 
      0.05369203       0.05369203       0.54885568 1.0 
      0.04295362       0.04295362       0.53908455 1.0 
      0.03221522       0.03221522       0.52931341 1.0 
      0.02147681       0.02147681       0.51954227 1.0 
      0.01073841       0.01073841       0.50977114 1.0 
      0.00000000       0.00000000       0.50000000 1.0 
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      0.01388889      -0.01388889       0.50000000 1.0 
      0.02777778      -0.02777778       0.50000000 1.0 
      0.04166667      -0.04166667       0.50000000 1.0 
      0.05555556      -0.05555556       0.50000000 1.0 
      0.06944444      -0.06944444       0.50000000 1.0 
      0.08333333      -0.08333333       0.50000000 1.0 
      0.09722222      -0.09722222       0.50000000 1.0 
      0.11111111      -0.11111111       0.50000000 1.0 
      0.12500000      -0.12500000       0.50000000 1.0 
      0.13888889      -0.13888889       0.50000000 1.0 
      0.15277778      -0.15277778       0.50000000 1.0 
      0.16666667      -0.16666667       0.50000000 1.0 
      0.18055556      -0.18055556       0.50000000 1.0 
      0.19444444      -0.19444444       0.50000000 1.0 
      0.20833333      -0.20833333       0.50000000 1.0 
      0.22222222      -0.22222222       0.50000000 1.0 
      0.23611111      -0.23611111       0.50000000 1.0 
      0.25000000      -0.25000000       0.50000000 1.0 
      0.26388889      -0.26388889       0.50000000 1.0 
      0.27777778      -0.27777778       0.50000000 1.0 
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      0.31944444      -0.31944444       0.50000000 1.0 
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      0.36111111      -0.36111111       0.50000000 1.0 
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      0.52742005      -0.47257995      -0.03571145 1.0 
      0.52056503      -0.47943497      -0.02678359 1.0 
      0.51371002      -0.48628998      -0.01785573 1.0 
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      0.01562500      -0.00000000       0.01562500 1.0 
      0.00000000       0.00000000       0.00000000 1.0 

