! Pwscf input file created with ciftopw.py 
! Compound: Li6ZnO4
&control
         calculation     = 'bands'
         prefix          = 'Li6ZnO4'
         restart_mode    = 'from_scratch'
         outdir          = './'
         wf_collect      = .true.
         verbosity       = 'high'
       /
&system
         ibrav           =  14
         celldm(1)       =           12.3353753657963985
         celldm(2)       =            1.0000000000000000
         celldm(3)       =            0.7124977020650776
         celldm(4)       =            0.0000000000000001
         celldm(5)       =            0.0000000000000001
         celldm(6)       =            0.0000000000000001
         nat             =       22
         ntyp            =        3
         ecutwfc         =      103.00000000
         ecutrho         =      412.00000000
         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 
Li   6.9410 Li.rel-pbe-s-rrkjus_psl.1.0.0.UPF 
Zn  65.4090 Zn.rel-pbe-dn-rrkjus_psl.1.0.0.UPF 
ATOMIC_POSITIONS crystal
K_POINTS crystal
281
      0.00000000       0.00000000       0.00000000 1.0 
      0.00000000       0.02000000       0.00000000 1.0 
      0.00000000       0.04000000       0.00000000 1.0 
      0.00000000       0.06000000       0.00000000 1.0 
      0.00000000       0.08000000       0.00000000 1.0 
      0.00000000       0.10000000       0.00000000 1.0 
      0.00000000       0.12000000       0.00000000 1.0 
      0.00000000       0.14000000       0.00000000 1.0 
      0.00000000       0.16000000       0.00000000 1.0 
      0.00000000       0.18000000       0.00000000 1.0 
      0.00000000       0.20000000       0.00000000 1.0 
      0.00000000       0.22000000       0.00000000 1.0 
      0.00000000       0.24000000       0.00000000 1.0 
      0.00000000       0.26000000       0.00000000 1.0 
      0.00000000       0.28000000       0.00000000 1.0 
      0.00000000       0.30000000       0.00000000 1.0 
      0.00000000       0.32000000       0.00000000 1.0 
      0.00000000       0.34000000       0.00000000 1.0 
      0.00000000       0.36000000       0.00000000 1.0 
      0.00000000       0.38000000       0.00000000 1.0 
      0.00000000       0.40000000       0.00000000 1.0 
      0.00000000       0.42000000       0.00000000 1.0 
      0.00000000       0.44000000       0.00000000 1.0 
      0.00000000       0.46000000       0.00000000 1.0 
      0.00000000       0.48000000       0.00000000 1.0 
      0.00000000       0.50000000       0.00000000 1.0 
      0.00000000       0.50000000       0.00000000 1.0 
      0.02000000       0.50000000       0.00000000 1.0 
      0.04000000       0.50000000       0.00000000 1.0 
      0.06000000       0.50000000       0.00000000 1.0 
      0.08000000       0.50000000       0.00000000 1.0 
      0.10000000       0.50000000       0.00000000 1.0 
      0.12000000       0.50000000       0.00000000 1.0 
      0.14000000       0.50000000       0.00000000 1.0 
      0.16000000       0.50000000       0.00000000 1.0 
      0.18000000       0.50000000       0.00000000 1.0 
      0.20000000       0.50000000       0.00000000 1.0 
      0.22000000       0.50000000       0.00000000 1.0 
      0.24000000       0.50000000       0.00000000 1.0 
      0.26000000       0.50000000       0.00000000 1.0 
      0.28000000       0.50000000       0.00000000 1.0 
      0.30000000       0.50000000       0.00000000 1.0 
      0.32000000       0.50000000       0.00000000 1.0 
      0.34000000       0.50000000       0.00000000 1.0 
      0.36000000       0.50000000       0.00000000 1.0 
      0.38000000       0.50000000       0.00000000 1.0 
      0.40000000       0.50000000       0.00000000 1.0 
      0.42000000       0.50000000       0.00000000 1.0 
      0.44000000       0.50000000       0.00000000 1.0 
      0.46000000       0.50000000       0.00000000 1.0 
      0.48000000       0.50000000       0.00000000 1.0 
      0.50000000       0.50000000       0.00000000 1.0 
      0.50000000       0.50000000       0.00000000 1.0 
      0.48571429       0.48571429       0.00000000 1.0 
      0.47142857       0.47142857       0.00000000 1.0 
      0.45714286       0.45714286       0.00000000 1.0 
      0.44285714       0.44285714       0.00000000 1.0 
      0.42857143       0.42857143       0.00000000 1.0 
      0.41428571       0.41428571       0.00000000 1.0 
      0.40000000       0.40000000       0.00000000 1.0 
      0.38571429       0.38571429       0.00000000 1.0 
      0.37142857       0.37142857       0.00000000 1.0 
      0.35714286       0.35714286       0.00000000 1.0 
      0.34285714       0.34285714       0.00000000 1.0 
      0.32857143       0.32857143       0.00000000 1.0 
      0.31428571       0.31428571       0.00000000 1.0 
      0.30000000       0.30000000       0.00000000 1.0 
      0.28571429       0.28571429       0.00000000 1.0 
      0.27142857       0.27142857       0.00000000 1.0 
      0.25714286       0.25714286       0.00000000 1.0 
      0.24285714       0.24285714       0.00000000 1.0 
      0.22857143       0.22857143       0.00000000 1.0 
      0.21428571       0.21428571       0.00000000 1.0 
      0.20000000       0.20000000       0.00000000 1.0 
      0.18571429       0.18571429       0.00000000 1.0 
      0.17142857       0.17142857       0.00000000 1.0 
      0.15714286       0.15714286       0.00000000 1.0 
      0.14285714       0.14285714       0.00000000 1.0 
      0.12857143       0.12857143       0.00000000 1.0 
      0.11428571       0.11428571       0.00000000 1.0 
      0.10000000       0.10000000       0.00000000 1.0 
      0.08571429       0.08571429       0.00000000 1.0 
      0.07142857       0.07142857       0.00000000 1.0 
      0.05714286       0.05714286       0.00000000 1.0 
      0.04285714       0.04285714       0.00000000 1.0 
      0.02857143       0.02857143       0.00000000 1.0 
      0.01428571       0.01428571       0.00000000 1.0 
      0.00000000       0.00000000       0.00000000 1.0 
      0.00000000       0.00000000       0.00000000 1.0 
      0.00000000       0.00000000       0.01470588 1.0 
      0.00000000       0.00000000       0.02941176 1.0 
      0.00000000       0.00000000       0.04411765 1.0 
      0.00000000       0.00000000       0.05882353 1.0 
      0.00000000       0.00000000       0.07352941 1.0 
      0.00000000       0.00000000       0.08823529 1.0 
      0.00000000       0.00000000       0.10294118 1.0 
      0.00000000       0.00000000       0.11764706 1.0 
      0.00000000       0.00000000       0.13235294 1.0 
      0.00000000       0.00000000       0.14705882 1.0 
      0.00000000       0.00000000       0.16176471 1.0 
      0.00000000       0.00000000       0.17647059 1.0 
      0.00000000       0.00000000       0.19117647 1.0 
      0.00000000       0.00000000       0.20588235 1.0 
      0.00000000       0.00000000       0.22058824 1.0 
      0.00000000       0.00000000       0.23529412 1.0 
      0.00000000       0.00000000       0.25000000 1.0 
      0.00000000       0.00000000       0.26470588 1.0 
      0.00000000       0.00000000       0.27941176 1.0 
      0.00000000       0.00000000       0.29411765 1.0 
      0.00000000       0.00000000       0.30882353 1.0 
      0.00000000       0.00000000       0.32352941 1.0 
      0.00000000       0.00000000       0.33823529 1.0 
      0.00000000       0.00000000       0.35294118 1.0 
      0.00000000      -0.00000000       0.36764706 1.0 
      0.00000000       0.00000000       0.38235294 1.0 
      0.00000000       0.00000000       0.39705882 1.0 
      0.00000000       0.00000000       0.41176471 1.0 
      0.00000000       0.00000000       0.42647059 1.0 
      0.00000000       0.00000000       0.44117647 1.0 
      0.00000000       0.00000000       0.45588235 1.0 
      0.00000000       0.00000000       0.47058824 1.0 
      0.00000000       0.00000000       0.48529412 1.0 
      0.00000000       0.00000000       0.50000000 1.0 
      0.00000000       0.00000000       0.50000000 1.0 
      0.00000000       0.02000000       0.50000000 1.0 
      0.00000000       0.04000000       0.50000000 1.0 
      0.00000000       0.06000000       0.50000000 1.0 
      0.00000000       0.08000000       0.50000000 1.0 
      0.00000000       0.10000000       0.50000000 1.0 
      0.00000000       0.12000000       0.50000000 1.0 
      0.00000000       0.14000000       0.50000000 1.0 
      0.00000000       0.16000000       0.50000000 1.0 
      0.00000000       0.18000000       0.50000000 1.0 
      0.00000000       0.20000000       0.50000000 1.0 
      0.00000000       0.22000000       0.50000000 1.0 
      0.00000000       0.24000000       0.50000000 1.0 
      0.00000000       0.26000000       0.50000000 1.0 
      0.00000000       0.28000000       0.50000000 1.0 
      0.00000000       0.30000000       0.50000000 1.0 
      0.00000000       0.32000000       0.50000000 1.0 
      0.00000000       0.34000000       0.50000000 1.0 
      0.00000000       0.36000000       0.50000000 1.0 
      0.00000000       0.38000000       0.50000000 1.0 
      0.00000000       0.40000000       0.50000000 1.0 
      0.00000000       0.42000000       0.50000000 1.0 
      0.00000000       0.44000000       0.50000000 1.0 
      0.00000000       0.46000000       0.50000000 1.0 
      0.00000000       0.48000000       0.50000000 1.0 
      0.00000000       0.50000000       0.50000000 1.0 
      0.00000000       0.50000000       0.50000000 1.0 
      0.02000000       0.50000000       0.50000000 1.0 
      0.04000000       0.50000000       0.50000000 1.0 
      0.06000000       0.50000000       0.50000000 1.0 
      0.08000000       0.50000000       0.50000000 1.0 
      0.10000000       0.50000000       0.50000000 1.0 
      0.12000000       0.50000000       0.50000000 1.0 
      0.14000000       0.50000000       0.50000000 1.0 
      0.16000000       0.50000000       0.50000000 1.0 
      0.18000000       0.50000000       0.50000000 1.0 
      0.20000000       0.50000000       0.50000000 1.0 
      0.22000000       0.50000000       0.50000000 1.0 
      0.24000000       0.50000000       0.50000000 1.0 
      0.26000000       0.50000000       0.50000000 1.0 
      0.28000000       0.50000000       0.50000000 1.0 
      0.30000000       0.50000000       0.50000000 1.0 
      0.32000000       0.50000000       0.50000000 1.0 
      0.34000000       0.50000000       0.50000000 1.0 
      0.36000000       0.50000000       0.50000000 1.0 
      0.38000000       0.50000000       0.50000000 1.0 
      0.40000000       0.50000000       0.50000000 1.0 
      0.42000000       0.50000000       0.50000000 1.0 
      0.44000000       0.50000000       0.50000000 1.0 
      0.46000000       0.50000000       0.50000000 1.0 
      0.48000000       0.50000000       0.50000000 1.0 
      0.50000000       0.50000000       0.50000000 1.0 
      0.50000000       0.50000000       0.50000000 1.0 
      0.48571429       0.48571429       0.50000000 1.0 
      0.47142857       0.47142857       0.50000000 1.0 
      0.45714286       0.45714286       0.50000000 1.0 
      0.44285714       0.44285714       0.50000000 1.0 
      0.42857143       0.42857143       0.50000000 1.0 
      0.41428571       0.41428571       0.50000000 1.0 
      0.40000000       0.40000000       0.50000000 1.0 
      0.38571429       0.38571429       0.50000000 1.0 
      0.37142857       0.37142857       0.50000000 1.0 
      0.35714286       0.35714286       0.50000000 1.0 
      0.34285714       0.34285714       0.50000000 1.0 
      0.32857143       0.32857143       0.50000000 1.0 
      0.31428571       0.31428571       0.50000000 1.0 
      0.30000000       0.30000000       0.50000000 1.0 
      0.28571429       0.28571429       0.50000000 1.0 
      0.27142857       0.27142857       0.50000000 1.0 
      0.25714286       0.25714286       0.50000000 1.0 
      0.24285714       0.24285714       0.50000000 1.0 
      0.22857143       0.22857143       0.50000000 1.0 
      0.21428571       0.21428571       0.50000000 1.0 
      0.20000000       0.20000000       0.50000000 1.0 
      0.18571429       0.18571429       0.50000000 1.0 
      0.17142857       0.17142857       0.50000000 1.0 
      0.15714286       0.15714286       0.50000000 1.0 
      0.14285714       0.14285714       0.50000000 1.0 
      0.12857143       0.12857143       0.50000000 1.0 
      0.11428571       0.11428571       0.50000000 1.0 
      0.10000000       0.10000000       0.50000000 1.0 
      0.08571429       0.08571429       0.50000000 1.0 
      0.07142857       0.07142857       0.50000000 1.0 
      0.05714286       0.05714286       0.50000000 1.0 
      0.04285714       0.04285714       0.50000000 1.0 
      0.02857143       0.02857143       0.50000000 1.0 
      0.01428571       0.01428571       0.50000000 1.0 
     -0.00000000      -0.00000000       0.50000000 1.0 
      0.00000000       0.50000000       0.00000000 1.0 
      0.00000000       0.50000000       0.01470588 1.0 
      0.00000000       0.50000000       0.02941176 1.0 
      0.00000000       0.50000000       0.04411765 1.0 
      0.00000000       0.50000000       0.05882353 1.0 
      0.00000000       0.50000000       0.07352941 1.0 
      0.00000000       0.50000000       0.08823529 1.0 
      0.00000000       0.50000000       0.10294118 1.0 
      0.00000000       0.50000000       0.11764706 1.0 
      0.00000000       0.50000000       0.13235294 1.0 
      0.00000000       0.50000000       0.14705882 1.0 
      0.00000000       0.50000000       0.16176471 1.0 
      0.00000000       0.50000000       0.17647059 1.0 
      0.00000000       0.50000000       0.19117647 1.0 
      0.00000000       0.50000000       0.20588235 1.0 
      0.00000000       0.50000000       0.22058824 1.0 
      0.00000000       0.50000000       0.23529412 1.0 
      0.00000000       0.50000000       0.25000000 1.0 
      0.00000000       0.50000000       0.26470588 1.0 
      0.00000000       0.50000000       0.27941176 1.0 
      0.00000000       0.50000000       0.29411765 1.0 
      0.00000000       0.50000000       0.30882353 1.0 
      0.00000000       0.50000000       0.32352941 1.0 
      0.00000000       0.50000000       0.33823529 1.0 
      0.00000000       0.50000000       0.35294118 1.0 
      0.00000000       0.50000000       0.36764706 1.0 
      0.00000000       0.50000000       0.38235294 1.0 
      0.00000000       0.50000000       0.39705882 1.0 
      0.00000000       0.50000000       0.41176471 1.0 
      0.00000000       0.50000000       0.42647059 1.0 
      0.00000000       0.50000000       0.44117647 1.0 
      0.00000000       0.50000000       0.45588235 1.0 
      0.00000000       0.50000000       0.47058824 1.0 
      0.00000000       0.50000000       0.48529412 1.0 
      0.00000000       0.50000000       0.50000000 1.0 
      0.50000000       0.50000000       0.00000000 1.0 
      0.50000000       0.50000000       0.01470588 1.0 
      0.50000000       0.50000000       0.02941176 1.0 
      0.50000000       0.50000000       0.04411765 1.0 
      0.50000000       0.50000000       0.05882353 1.0 
      0.50000000       0.50000000       0.07352941 1.0 
      0.50000000       0.50000000       0.08823529 1.0 
      0.50000000       0.50000000       0.10294118 1.0 
      0.50000000       0.50000000       0.11764706 1.0 
      0.50000000       0.50000000       0.13235294 1.0 
      0.50000000       0.50000000       0.14705882 1.0 
      0.50000000       0.50000000       0.16176471 1.0 
      0.50000000       0.50000000       0.17647059 1.0 
      0.50000000       0.50000000       0.19117647 1.0 
      0.50000000       0.50000000       0.20588235 1.0 
      0.50000000       0.50000000       0.22058824 1.0 
      0.50000000       0.50000000       0.23529412 1.0 
      0.50000000       0.50000000       0.25000000 1.0 
      0.50000000       0.50000000       0.26470588 1.0 
      0.50000000       0.50000000       0.27941176 1.0 
      0.50000000       0.50000000       0.29411765 1.0 
      0.50000000       0.50000000       0.30882353 1.0 
      0.50000000       0.50000000       0.32352941 1.0 
      0.50000000       0.50000000       0.33823529 1.0 
      0.50000000       0.50000000       0.35294118 1.0 
      0.50000000       0.50000000       0.36764706 1.0 
      0.50000000       0.50000000       0.38235294 1.0 
      0.50000000       0.50000000       0.39705882 1.0 
      0.50000000       0.50000000       0.41176471 1.0 
      0.50000000       0.50000000       0.42647059 1.0 
      0.50000000       0.50000000       0.44117647 1.0 
      0.50000000       0.50000000       0.45588235 1.0 
      0.50000000       0.50000000       0.47058824 1.0 
      0.50000000       0.50000000       0.48529412 1.0 
      0.50000000       0.50000000       0.50000000 1.0 

