! Pwscf input file created with ciftopw.py 
! Compound: TiMnO3
&control
         calculation     = 'bands'
         prefix          = 'TiMnO3'
         restart_mode    = 'from_scratch'
         outdir          = './'
         wf_collect      = .true.
         verbosity       = 'high'
       /
&system
         ibrav           =  14
         celldm(1)       =           10.3093089375609104
         celldm(2)       =            1.0000000000000000
         celldm(3)       =            0.9999999999999998
         celldm(4)       =            0.5478578270050577
         celldm(5)       =            0.5478578270050577
         celldm(6)       =            0.5478578270050577
         nat             =       10
         ntyp            =        3
         ecutwfc         =       57.00000000
         ecutrho         =      803.00000000
         occupations     =  'smearing'  
         smearing        =  'f-d' 
         degauss         =        1.00000000e-03  
         noncolin        =  .true. 
         lspinorb        =  .true. 
/
&electrons
         conv_thr        =        1.00000000e-08 
         mixing_beta     =        3.00000000e-01    
   /
ATOMIC_SPECIES
 O  15.9994 O.rel-pbe-n-rrkjus_psl.1.0.0.UPF 
Mn  54.9380 Mn.rel-pbe-spn-rrkjus_psl.1.0.0.UPF 
Ti  47.8670 Ti.rel-pbe-spn-rrkjus_psl.1.0.0.UPF 
ATOMIC_POSITIONS crystal
K_POINTS crystal
270
      0.00000000       0.00000000       0.00000000 1.0 
      0.01351351       0.00000000      -0.00000000 1.0 
      0.02702703       0.00000000      -0.00000000 1.0 
      0.04054054       0.00000000       0.00000000 1.0 
      0.05405405       0.00000000      -0.00000000 1.0 
      0.06756757       0.00000000      -0.00000000 1.0 
      0.08108108       0.00000000       0.00000000 1.0 
      0.09459459      -0.00000000       0.00000000 1.0 
      0.10810811       0.00000000      -0.00000000 1.0 
      0.12162162       0.00000000       0.00000000 1.0 
      0.13513514       0.00000000      -0.00000000 1.0 
      0.14864865      -0.00000000       0.00000000 1.0 
      0.16216216       0.00000000       0.00000000 1.0 
      0.17567568       0.00000000       0.00000000 1.0 
      0.18918919      -0.00000000       0.00000000 1.0 
      0.20270270      -0.00000000      -0.00000000 1.0 
      0.21621622       0.00000000      -0.00000000 1.0 
      0.22972973       0.00000000       0.00000000 1.0 
      0.24324324       0.00000000       0.00000000 1.0 
      0.25675676       0.00000000      -0.00000000 1.0 
      0.27027027       0.00000000      -0.00000000 1.0 
      0.28378378       0.00000000       0.00000000 1.0 
      0.29729730      -0.00000000       0.00000000 1.0 
      0.31081081       0.00000000      -0.00000000 1.0 
      0.32432432       0.00000000       0.00000000 1.0 
      0.33783784       0.00000000       0.00000000 1.0 
      0.35135135       0.00000000       0.00000000 1.0 
      0.36486486      -0.00000000      -0.00000000 1.0 
      0.37837838      -0.00000000       0.00000000 1.0 
      0.39189189      -0.00000000      -0.00000000 1.0 
      0.40540541      -0.00000000      -0.00000000 1.0 
      0.41891892       0.00000000       0.00000000 1.0 
      0.43243243       0.00000000      -0.00000000 1.0 
      0.44594595       0.00000000       0.00000000 1.0 
      0.45945946       0.00000000       0.00000000 1.0 
      0.47297297       0.00000000      -0.00000000 1.0 
      0.48648649       0.00000000       0.00000000 1.0 
      0.50000000       0.00000000       0.00000000 1.0 
      0.50000000       0.00000000       0.00000000 1.0 
      0.50000000       0.00822696      -0.00822696 1.0 
      0.50000000       0.01645393      -0.01645393 1.0 
      0.50000000       0.02468089      -0.02468089 1.0 
      0.50000000       0.03290786      -0.03290786 1.0 
      0.50000000       0.04113482      -0.04113482 1.0 
      0.50000000       0.04936179      -0.04936179 1.0 
      0.50000000       0.05758875      -0.05758875 1.0 
      0.50000000       0.06581572      -0.06581572 1.0 
      0.50000000       0.07404268      -0.07404268 1.0 
      0.50000000       0.08226965      -0.08226965 1.0 
      0.50000000       0.09049661      -0.09049661 1.0 
      0.50000000       0.09872358      -0.09872358 1.0 
      0.50000000       0.10695054      -0.10695054 1.0 
      0.50000000       0.11517751      -0.11517751 1.0 
      0.50000000       0.12340447      -0.12340447 1.0 
      0.50000000       0.13163144      -0.13163144 1.0 
      0.50000000       0.13985840      -0.13985840 1.0 
      0.50000000       0.14808537      -0.14808537 1.0 
      0.50000000       0.15631233      -0.15631233 1.0 
      0.50000000       0.16453930      -0.16453930 1.0 
      0.50000000       0.17276626      -0.17276626 1.0 
      0.50000000       0.18099323      -0.18099323 1.0 
      0.50000000       0.18922019      -0.18922019 1.0 
      0.50000000       0.19744716      -0.19744716 1.0 
      0.50000000       0.20567412      -0.20567412 1.0 
      0.50000000       0.21390109      -0.21390109 1.0 
      0.50000000       0.22212805      -0.22212805 1.0 
      0.50000000       0.23035502      -0.23035502 1.0 
      0.50000000       0.23858198      -0.23858198 1.0 
      0.76141802       0.50000000       0.23858198 1.0 
      0.75324870       0.50000000       0.24675130 1.0 
      0.74507939       0.50000000       0.25492061 1.0 
      0.73691008       0.50000000       0.26308992 1.0 
      0.72874076       0.50000000       0.27125924 1.0 
      0.72057145       0.50000000       0.27942855 1.0 
      0.71240214       0.50000000       0.28759786 1.0 
      0.70423282       0.50000000       0.29576718 1.0 
      0.69606351       0.50000000       0.30393649 1.0 
      0.68789420       0.50000000       0.31210580 1.0 
      0.67972489       0.50000000       0.32027511 1.0 
      0.67155557       0.50000000       0.32844443 1.0 
      0.66338626       0.50000000       0.33661374 1.0 
      0.65521695       0.50000000       0.34478305 1.0 
      0.64704763       0.50000000       0.35295237 1.0 
      0.63887832       0.50000000       0.36112168 1.0 
      0.63070901       0.50000000       0.36929099 1.0 
      0.62253969       0.50000000       0.37746031 1.0 
      0.61437038       0.50000000       0.38562962 1.0 
      0.60620107       0.50000000       0.39379893 1.0 
      0.59803176       0.50000000       0.40196824 1.0 
      0.58986244       0.50000000       0.41013756 1.0 
      0.58169313       0.50000000       0.41830687 1.0 
      0.57352382       0.50000000       0.42647618 1.0 
      0.56535450       0.50000000       0.43464550 1.0 
      0.55718519       0.50000000       0.44281481 1.0 
      0.54901588       0.50000000       0.45098412 1.0 
      0.54084656       0.50000000       0.45915344 1.0 
      0.53267725       0.50000000       0.46732275 1.0 
      0.52450794       0.50000000       0.47549206 1.0 
      0.51633863       0.50000000       0.48366137 1.0 
      0.50816931       0.50000000       0.49183069 1.0 
      0.50000000       0.50000000       0.50000000 1.0 
      0.50000000       0.50000000       0.50000000 1.0 
      0.48571429       0.48571429       0.48571429 1.0 
      0.47142857       0.47142857       0.47142857 1.0 
      0.45714286       0.45714286       0.45714286 1.0 
      0.44285714       0.44285714       0.44285714 1.0 
      0.42857143       0.42857143       0.42857143 1.0 
      0.41428571       0.41428571       0.41428571 1.0 
      0.40000000       0.40000000       0.40000000 1.0 
      0.38571429       0.38571429       0.38571429 1.0 
      0.37142857       0.37142857       0.37142857 1.0 
      0.35714286       0.35714286       0.35714286 1.0 
      0.34285714       0.34285714       0.34285714 1.0 
      0.32857143       0.32857143       0.32857143 1.0 
      0.31428571       0.31428571       0.31428571 1.0 
      0.30000000       0.30000000       0.30000000 1.0 
      0.28571429       0.28571429       0.28571429 1.0 
      0.27142857       0.27142857       0.27142857 1.0 
      0.25714286       0.25714286       0.25714286 1.0 
      0.24285714       0.24285714       0.24285714 1.0 
      0.22857143       0.22857143       0.22857143 1.0 
      0.21428571       0.21428571       0.21428571 1.0 
      0.20000000       0.20000000       0.20000000 1.0 
      0.18571429       0.18571429       0.18571429 1.0 
      0.17142857       0.17142857       0.17142857 1.0 
      0.15714286       0.15714286       0.15714286 1.0 
      0.14285714       0.14285714       0.14285714 1.0 
      0.12857143       0.12857143       0.12857143 1.0 
      0.11428571       0.11428571       0.11428571 1.0 
      0.10000000       0.10000000       0.10000000 1.0 
      0.08571429       0.08571429       0.08571429 1.0 
      0.07142857       0.07142857       0.07142857 1.0 
      0.05714286       0.05714286       0.05714286 1.0 
      0.04285714       0.04285714       0.04285714 1.0 
      0.02857143       0.02857143       0.02857143 1.0 
      0.01428571       0.01428571       0.01428571 1.0 
      0.00000000       0.00000000       0.00000000 1.0 
      0.00000000       0.00000000       0.00000000 1.0 
      0.00820647       0.00000000      -0.00820647 1.0 
      0.01641293       0.00000000      -0.01641293 1.0 
      0.02461940       0.00000000      -0.02461940 1.0 
      0.03282587       0.00000000      -0.03282587 1.0 
      0.04103233       0.00000000      -0.04103233 1.0 
      0.04923880       0.00000000      -0.04923880 1.0 
      0.05744527       0.00000000      -0.05744527 1.0 
      0.06565173       0.00000000      -0.06565173 1.0 
      0.07385820      -0.00000000      -0.07385820 1.0 
      0.08206466       0.00000000      -0.08206466 1.0 
      0.09027113       0.00000000      -0.09027113 1.0 
      0.09847760       0.00000000      -0.09847760 1.0 
      0.10668406      -0.00000000      -0.10668406 1.0 
      0.11489053       0.00000000      -0.11489053 1.0 
      0.12309700      -0.00000000      -0.12309700 1.0 
      0.13130346       0.00000000      -0.13130346 1.0 
      0.13950993       0.00000000      -0.13950993 1.0 
      0.14771640      -0.00000000      -0.14771640 1.0 
      0.15592286      -0.00000000      -0.15592286 1.0 
      0.16412933       0.00000000      -0.16412933 1.0 
      0.17233580      -0.00000000      -0.17233580 1.0 
      0.18054226       0.00000000      -0.18054226 1.0 
      0.18874873      -0.00000000      -0.18874873 1.0 
      0.19695520       0.00000000      -0.19695520 1.0 
      0.20516166      -0.00000000      -0.20516166 1.0 
      0.21336813      -0.00000000      -0.21336813 1.0 
      0.22157460       0.00000000      -0.22157460 1.0 
      0.22978106       0.00000000      -0.22978106 1.0 
      0.23798753       0.00000000      -0.23798753 1.0 
      0.24619399      -0.00000000      -0.24619399 1.0 
      0.25440046       0.00000000      -0.25440046 1.0 
      0.26260693       0.00000000      -0.26260693 1.0 
      0.27081339       0.00000000      -0.27081339 1.0 
      0.27901986       0.00000000      -0.27901986 1.0 
      0.28722633       0.00000000      -0.28722633 1.0 
      0.29543279      -0.00000000      -0.29543279 1.0 
      0.30363926      -0.00000000      -0.30363926 1.0 
      0.31184573      -0.00000000      -0.31184573 1.0 
      0.32005219       0.00000000      -0.32005219 1.0 
      0.32825866       0.00000000      -0.32825866 1.0 
      0.33646513       0.00000000      -0.33646513 1.0 
      0.34467159      -0.00000000      -0.34467159 1.0 
      0.35287806      -0.00000000      -0.35287806 1.0 
      0.36108453       0.00000000      -0.36108453 1.0 
      0.36929099       0.00000000      -0.36929099 1.0 
      0.63070901       0.36929099       0.00000000 1.0 
      0.62253969       0.37746031       0.00000000 1.0 
      0.61437038       0.38562962       0.00000000 1.0 
      0.60620107       0.39379893       0.00000000 1.0 
      0.59803176       0.40196824       0.00000000 1.0 
      0.58986244       0.41013756       0.00000000 1.0 
      0.58169313       0.41830687       0.00000000 1.0 
      0.57352382       0.42647618       0.00000000 1.0 
      0.56535450       0.43464550       0.00000000 1.0 
      0.55718519       0.44281481       0.00000000 1.0 
      0.54901588       0.45098412       0.00000000 1.0 
      0.54084656       0.45915344       0.00000000 1.0 
      0.53267725       0.46732275       0.00000000 1.0 
      0.52450794       0.47549206       0.00000000 1.0 
      0.51633863       0.48366137       0.00000000 1.0 
      0.50816931       0.49183069       0.00000000 1.0 
      0.50000000       0.50000000       0.00000000 1.0 
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      0.50933636       0.50933636       0.01704157 1.0 
      0.51867272       0.51867272       0.03408314 1.0 
      0.52800907       0.52800907       0.05112471 1.0 
      0.53734543       0.53734543       0.06816628 1.0 
      0.54668179       0.54668179       0.08520785 1.0 
      0.55601815       0.55601815       0.10224942 1.0 
      0.56535450       0.56535450       0.11929099 1.0 
      0.57469086       0.57469086       0.13633256 1.0 
      0.58402722       0.58402722       0.15337413 1.0 
      0.59336358       0.59336358       0.17041570 1.0 
      0.60269993       0.60269993       0.18745727 1.0 
      0.61203629       0.61203629       0.20449884 1.0 
      0.62137265       0.62137265       0.22154041 1.0 
      0.63070901       0.63070901       0.23858198 1.0 
      0.63070901       0.63070901       0.23858198 1.0 
      0.62604083       0.62604083       0.24791834 1.0 
      0.62137265       0.62137265       0.25725470 1.0 
      0.61670447       0.61670447       0.26659106 1.0 
      0.61203629       0.61203629       0.27592742 1.0 
      0.60736811       0.60736811       0.28526377 1.0 
      0.60269993       0.60269993       0.29460013 1.0 
      0.59803176       0.59803176       0.30393649 1.0 
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      0.58869540       0.58869540       0.32260920 1.0 
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      0.57935904       0.57935904       0.34128192 1.0 
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      0.57002268       0.57002268       0.35995463 1.0 
      0.56535450       0.56535450       0.36929099 1.0 
      0.56068632       0.56068632       0.37862735 1.0 
      0.55601815       0.55601815       0.38796371 1.0 
      0.55134997       0.55134997       0.39730007 1.0 
      0.54668179       0.54668179       0.40663642 1.0 
      0.54201361       0.54201361       0.41597278 1.0 
      0.53734543       0.53734543       0.42530914 1.0 
      0.53267725       0.53267725       0.43464550 1.0 
      0.52800907       0.52800907       0.44398185 1.0 
      0.52334089       0.52334089       0.45331821 1.0 
      0.51867272       0.51867272       0.46265457 1.0 
      0.51400454       0.51400454       0.47199093 1.0 
      0.50933636       0.50933636       0.48132728 1.0 
      0.50466818       0.50466818       0.49066364 1.0 
      0.50000000       0.50000000       0.50000000 1.0 
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      0.51045672       0.01477164       0.01477164 1.0 
      0.52091344       0.02954328       0.02954328 1.0 
      0.53137016       0.04431492       0.04431492 1.0 
      0.54182688       0.05908656       0.05908656 1.0 
      0.55228360       0.07385820       0.07385820 1.0 
      0.56274032       0.08862984       0.08862984 1.0 
      0.57319704       0.10340148       0.10340148 1.0 
      0.58365376       0.11817312       0.11817312 1.0 
      0.59411049       0.13294476       0.13294476 1.0 
      0.60456721       0.14771640       0.14771640 1.0 
      0.61502393       0.16248804       0.16248804 1.0 
      0.62548065       0.17725968       0.17725968 1.0 
      0.63593737       0.19203132       0.19203132 1.0 
      0.64639409       0.20680296       0.20680296 1.0 
      0.65685081       0.22157460       0.22157460 1.0 
      0.66730753       0.23634624       0.23634624 1.0 
      0.67776425       0.25111787       0.25111787 1.0 
      0.68822097       0.26588951       0.26588951 1.0 
      0.69867769       0.28066115       0.28066115 1.0 
      0.70913441       0.29543279       0.29543279 1.0 
      0.71959113       0.31020443       0.31020443 1.0 
      0.73004785       0.32497607       0.32497607 1.0 
      0.74050457       0.33974771       0.33974771 1.0 
      0.75096129       0.35451935       0.35451935 1.0 
      0.76141802       0.36929099       0.36929099 1.0 

