&CONTROL
   verbosity        = 'high'
   tstress          = .true.
   tprnfor          = .true.
   outdir           = '/var/www/html/data/material_modeling/7221526.cif-QuantumEspresso-com-ailes-20231003-163424/'
   pseudo_dir       = '/usr/share/espresso/pseudo'
/
&SYSTEM
   ecutwfc          = 10.0
   occupations      = 'smearing'
   degauss          = 0.009558823529411765
   smearing         = 'methfessel-paxton'
   ntyp             = 1
   nat              = 12
   ibrav            = 0
/
&ELECTRONS
   conv_thr         = 1e-05
   mixing_beta      = 0.7
   diagonalization  = 'david'
/
&IONS
/
&CELL
/

ATOMIC_SPECIES
Ge 72.63 ge_pbe_v1.4.uspp.F.UPF

K_POINTS automatic
3 3 3  0 0 0

CELL_PARAMETERS angstrom
5.91640000000000 0.00000000000000 0.00000000000000
0.00000000000000 5.91640000000000 0.00000000000000
0.00000000000000 0.00000000000000 6.95550000000000

ATOMIC_POSITIONS angstrom
Ge 1.0353700000 2.1831516000 1.7945190000 
Ge 0.7750484000 3.9935700000 0.0556440000 
Ge 4.8810300000 3.7332484000 5.2722690000 
Ge 5.1413516000 1.9228300000 3.5333940000 
Ge 3.9935700000 0.7750484000 6.8998560000 
Ge 2.1831516000 1.0353700000 5.1609810000 
Ge 1.9228300000 5.1413516000 3.4221060000 
Ge 3.7332484000 4.8810300000 1.6832310000 
Ge 0.5324760000 0.5324760000 0.0000000000 
Ge 2.4257240000 3.4906760000 5.2166250000 
Ge 5.3839240000 5.3839240000 3.4777500000 
Ge 3.4906760000 2.4257240000 1.7388750000