! Pwscf input file created with ciftopw.py 
! Compound: GaI3
&control
         calculation     = 'bands'
         prefix          = 'GaI3'
         restart_mode    = 'from_scratch'
         outdir          = './'
         wf_collect      = .true.
         verbosity       = 'high'
       /
&system
         ibrav           =  14
         celldm(1)       =           11.4970929170759995
         celldm(2)       =            1.5752794214332675
         celldm(3)       =            1.9459237343852733
         celldm(4)       =            0.3053629304896648
         celldm(5)       =            0.0000000000000001
         celldm(6)       =            0.0000000000000001
         nat             =       16
         ntyp            =        2
         ecutwfc         =       44.00000000
         ecutrho         =      240.00000000
         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
 I 126.9045 I.rel-pbe-n-rrkjus_psl.1.0.0.UPF 
Ga  69.7230 Ga.rel-pbe-dnl-rrkjus_psl.1.0.0.UPF 
ATOMIC_POSITIONS crystal
K_POINTS crystal
177
      0.00000000       0.00000000       0.00000000 1.0 
      0.00000000       0.00000000       0.03571429 1.0 
      0.00000000       0.00000000       0.07142857 1.0 
      0.00000000       0.00000000       0.10714286 1.0 
      0.00000000       0.00000000       0.14285714 1.0 
      0.00000000       0.00000000       0.17857143 1.0 
      0.00000000       0.00000000       0.21428571 1.0 
      0.00000000       0.00000000       0.25000000 1.0 
      0.00000000       0.00000000       0.28571429 1.0 
      0.00000000       0.00000000       0.32142857 1.0 
      0.00000000       0.00000000       0.35714286 1.0 
      0.00000000       0.00000000       0.39285714 1.0 
      0.00000000       0.00000000       0.42857143 1.0 
      0.00000000       0.00000000       0.46428571 1.0 
      0.00000000       0.00000000       0.50000000 1.0 
      0.00000000       0.00000000       0.50000000 1.0 
      0.00000000       0.02965053       0.51118451 1.0 
      0.00000000       0.05930106       0.52236902 1.0 
      0.00000000       0.08895159       0.53355353 1.0 
      0.00000000       0.11860212       0.54473804 1.0 
      0.00000000       0.14825265       0.55592255 1.0 
      0.00000000       0.17790318       0.56710707 1.0 
      0.00000000       0.20755371       0.57829158 1.0 
      0.00000000       0.23720424       0.58947609 1.0 
      0.00000000       0.26685477       0.60066060 1.0 
      0.00000000       0.29650531       0.61184511 1.0 
      0.00000000       0.32615584       0.62302962 1.0 
      0.00000000       0.35580637       0.63421413 1.0 
      0.00000000       0.38545690       0.64539864 1.0 
      0.00000000       0.41510743       0.65658315 1.0 
      0.00000000       0.41510743       0.65658315 1.0 
      0.00000000       0.42925619       0.63048596 1.0 
      0.00000000       0.44340495       0.60438877 1.0 
      0.00000000       0.45755371       0.57829158 1.0 
      0.00000000       0.47170248       0.55219438 1.0 
      0.00000000       0.48585124       0.52609719 1.0 
      0.00000000       0.50000000       0.50000000 1.0 
      0.00000000       0.50000000       0.50000000 1.0 
      0.01923077       0.50000000       0.50000000 1.0 
      0.03846154       0.50000000       0.50000000 1.0 
      0.05769231       0.50000000       0.50000000 1.0 
      0.07692308       0.50000000       0.50000000 1.0 
      0.09615385       0.50000000       0.50000000 1.0 
      0.11538462       0.50000000       0.50000000 1.0 
      0.13461538       0.50000000       0.50000000 1.0 
      0.15384615       0.50000000       0.50000000 1.0 
      0.17307692       0.50000000       0.50000000 1.0 
      0.19230769       0.50000000       0.50000000 1.0 
      0.21153846       0.50000000       0.50000000 1.0 
      0.23076923       0.50000000       0.50000000 1.0 
      0.25000000       0.50000000       0.50000000 1.0 
      0.26923077       0.50000000       0.50000000 1.0 
      0.28846154       0.50000000       0.50000000 1.0 
      0.30769231       0.50000000       0.50000000 1.0 
      0.32692308       0.50000000       0.50000000 1.0 
      0.34615385       0.50000000       0.50000000 1.0 
      0.36538462       0.50000000       0.50000000 1.0 
      0.38461538       0.50000000       0.50000000 1.0 
      0.40384615       0.50000000       0.50000000 1.0 
      0.42307692       0.50000000       0.50000000 1.0 
      0.44230769       0.50000000       0.50000000 1.0 
      0.46153846       0.50000000       0.50000000 1.0 
      0.48076923       0.50000000       0.50000000 1.0 
      0.50000000       0.50000000       0.50000000 1.0 
      0.50000000       0.50000000       0.50000000 1.0 
      0.50000000       0.51414876       0.47390281 1.0 
      0.50000000       0.52829752       0.44780562 1.0 
      0.50000000       0.54244629       0.42170842 1.0 
      0.50000000       0.55659505       0.39561123 1.0 
      0.50000000       0.57074381       0.36951404 1.0 
      0.50000000       0.58489257       0.34341685 1.0 
      0.50000000       0.58489257       0.34341685 1.0 
      0.50000000       0.57640332       0.30907516 1.0 
      0.50000000       0.56791406       0.27473348 1.0 
      0.50000000       0.55942480       0.24039179 1.0 
      0.50000000       0.55093554       0.20605011 1.0 
      0.50000000       0.54244629       0.17170842 1.0 
      0.50000000       0.53395703       0.13736674 1.0 
      0.50000000       0.52546777       0.10302505 1.0 
      0.50000000       0.51697851       0.06868337 1.0 
      0.50000000       0.50848926       0.03434168 1.0 
      0.50000000       0.50000000       0.00000000 1.0 
      0.50000000       0.50000000       0.00000000 1.0 
      0.48076923       0.50000000       0.00000000 1.0 
      0.46153846       0.50000000       0.00000000 1.0 
      0.44230769       0.50000000       0.00000000 1.0 
      0.42307692       0.50000000       0.00000000 1.0 
      0.40384615       0.50000000       0.00000000 1.0 
      0.38461538       0.50000000       0.00000000 1.0 
      0.36538462       0.50000000       0.00000000 1.0 
      0.34615385       0.50000000       0.00000000 1.0 
      0.32692308       0.50000000       0.00000000 1.0 
      0.30769231       0.50000000       0.00000000 1.0 
      0.28846154       0.50000000       0.00000000 1.0 
      0.26923077       0.50000000       0.00000000 1.0 
      0.25000000       0.50000000       0.00000000 1.0 
      0.23076923       0.50000000       0.00000000 1.0 
      0.21153846       0.50000000       0.00000000 1.0 
      0.19230769       0.50000000       0.00000000 1.0 
      0.17307692       0.50000000       0.00000000 1.0 
      0.15384615       0.50000000       0.00000000 1.0 
      0.13461538       0.50000000       0.00000000 1.0 
      0.11538462       0.50000000       0.00000000 1.0 
      0.09615385       0.50000000       0.00000000 1.0 
      0.07692308       0.50000000       0.00000000 1.0 
      0.05769231       0.50000000       0.00000000 1.0 
      0.03846154       0.50000000       0.00000000 1.0 
      0.01923077       0.50000000       0.00000000 1.0 
      0.00000000       0.50000000       0.00000000 1.0 
      0.00000000       0.50000000       0.00000000 1.0 
      0.00000000       0.50848926       0.03434168 1.0 
      0.00000000       0.51697851       0.06868337 1.0 
      0.00000000       0.52546777       0.10302505 1.0 
      0.00000000       0.53395703       0.13736674 1.0 
      0.00000000       0.54244629       0.17170842 1.0 
      0.00000000       0.55093554       0.20605011 1.0 
      0.00000000       0.55942480       0.24039179 1.0 
      0.00000000       0.56791406       0.27473348 1.0 
      0.00000000       0.57640332       0.30907516 1.0 
      0.00000000       0.58489257       0.34341685 1.0 
      0.50000000       0.41510743       0.65658315 1.0 
      0.50000000       0.38545690       0.64539864 1.0 
      0.50000000       0.35580637       0.63421413 1.0 
      0.50000000       0.32615584       0.62302962 1.0 
      0.50000000       0.29650531       0.61184511 1.0 
      0.50000000       0.26685477       0.60066060 1.0 
      0.50000000       0.23720424       0.58947609 1.0 
      0.50000000       0.20755371       0.57829158 1.0 
      0.50000000       0.17790318       0.56710707 1.0 
      0.50000000       0.14825265       0.55592255 1.0 
      0.50000000       0.11860212       0.54473804 1.0 
      0.50000000       0.08895159       0.53355353 1.0 
      0.50000000       0.05930106       0.52236902 1.0 
      0.50000000       0.02965053       0.51118451 1.0 
      0.50000000       0.00000000       0.50000000 1.0 
      0.50000000       0.00000000       0.50000000 1.0 
      0.50000000       0.00000000       0.46428571 1.0 
      0.50000000       0.00000000       0.42857143 1.0 
      0.50000000       0.00000000       0.39285714 1.0 
      0.50000000       0.00000000       0.35714286 1.0 
      0.50000000       0.00000000       0.32142857 1.0 
      0.50000000       0.00000000       0.28571429 1.0 
      0.50000000       0.00000000       0.25000000 1.0 
      0.50000000       0.00000000       0.21428571 1.0 
      0.50000000       0.00000000       0.17857143 1.0 
      0.50000000       0.00000000       0.14285714 1.0 
      0.50000000       0.00000000       0.10714286 1.0 
      0.50000000       0.00000000       0.07142857 1.0 
      0.50000000       0.00000000       0.03571429 1.0 
      0.50000000       0.00000000       0.00000000 1.0 
      0.00000000       0.00000000       0.50000000 1.0 
      0.01923077       0.00000000       0.50000000 1.0 
      0.03846154       0.00000000       0.50000000 1.0 
      0.05769231       0.00000000       0.50000000 1.0 
      0.07692308       0.00000000       0.50000000 1.0 
      0.09615385       0.00000000       0.50000000 1.0 
      0.11538462       0.00000000       0.50000000 1.0 
      0.13461538       0.00000000       0.50000000 1.0 
      0.15384615       0.00000000       0.50000000 1.0 
      0.17307692       0.00000000       0.50000000 1.0 
      0.19230769       0.00000000       0.50000000 1.0 
      0.21153846       0.00000000       0.50000000 1.0 
      0.23076923       0.00000000       0.50000000 1.0 
      0.25000000       0.00000000       0.50000000 1.0 
      0.26923077       0.00000000       0.50000000 1.0 
      0.28846154       0.00000000       0.50000000 1.0 
      0.30769231       0.00000000       0.50000000 1.0 
      0.32692308       0.00000000       0.50000000 1.0 
      0.34615385       0.00000000       0.50000000 1.0 
      0.36538462       0.00000000       0.50000000 1.0 
      0.38461538       0.00000000       0.50000000 1.0 
      0.40384615       0.00000000       0.50000000 1.0 
      0.42307692       0.00000000       0.50000000 1.0 
      0.44230769       0.00000000       0.50000000 1.0 
      0.46153846       0.00000000       0.50000000 1.0 
      0.48076923       0.00000000       0.50000000 1.0 
      0.50000000       0.00000000       0.50000000 1.0 

