! Pwscf input file created with ciftopw.py 
! Compound: Al2Si4O11
&control
         calculation     = 'scf'
         prefix          = 'Al2Si4O11'
         restart_mode    = 'from_scratch'
         outdir          = './'
         wf_collect      = .true.
         verbosity       = 'high'
       /
&system
         ibrav           =  14
         celldm(1)       =            9.8265751427999994
         celldm(2)       =            1.0045732487795467
         celldm(3)       =            1.8173076923076918
         celldm(4)       =            0.0458371548609291
         celldm(5)       =           -0.1535032504599646
         celldm(6)       =           -0.4828974266526201
         nat             =       17
         ntyp            =        3
         ecutwfc         =       47.00000000
         ecutrho         =      324.00000000
         occupations     =  'smearing'  
         smearing        =  'f-d' 
         degauss         =        1.00000000e-03  
         noncolin        =  .true. 
         lspinorb        =  .true. 
/
&electrons
         conv_thr        =        1.00000000e-08 
         mixing_beta     =        7.00000000e-01    
   /
ATOMIC_SPECIES
 O  15.9994 O.rel-pbe-n-rrkjus_psl.1.0.0.UPF 
Al  26.9815 Al.rel-pbe-n-rrkjus_psl.1.0.0.UPF 
Si  28.0855 Si.rel-pbe-n-rrkjus_psl.1.0.0.UPF 
ATOMIC_POSITIONS crystal
K_POINTS automatic
6 6 3 0 0 0