&control
     calculation = 'scf'
     restart_mode='from_scratch'
     prefix='Mo2S3',
     disk_io='low',
     wf_collect=.TRUE.
     pseudo_dir='/home/che/koroteev/qe/pseudo',
     outdir='/sfs/che/koroteev/G-X'
 /
 &system
     ibrav=0,
     celldm(1)=1.89036,
     nat=10,
     ntyp=2,
     ecutwfc=25.0,
     ecutrho=250.0,
     nbnd=30
 /
 &electrons
     mixing_beta = 0.3,
     conv_thr =  1.0d-8
 /
CELL_PARAMETERS {cubic}
6.08680 0.00000 0.00000
0.00000 3.20460 0.00000
-1.8581 0.00000 8.42070
ATOMIC_SPECIES
Mo 42.0 Mo.pw91-n-van.UPF
S  16.0 S.pw91-van_ak.UPF
ATOMIC_POSITIONS {crystal}
Mo 0.309630 0.250000 0.009240
Mo 0.690370 0.750000 0.990760
Mo 0.109070 0.250000 0.630580
Mo 0.890930 0.750000 0.369420
S 0.510440 0.250000 0.803500
S 0.489560 0.750000 0.196500
S 0.972050 0.250000 0.156560
S 0.027950 0.750000 0.843440
S 0.728210 0.250000 0.513740
S 0.271790 0.750000 0.486260
K_POINTS {automatic}
24 24 24 0 0 0