# generated using pymatgen
data_SiO2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   13.78595752
_cell_length_b   4.84238110
_cell_length_c   8.74369771
_cell_angle_alpha   90.00000000
_cell_angle_beta   128.98396773
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SiO2
_chemical_formula_sum   'Si12 O24'
_cell_volume   453.72426921
_cell_formula_units_Z   12
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
loop_
 _atom_type_symbol
 _atom_type_oxidation_number
  Si4+  4.0
  O2-  -2.0
loop_
 _atom_site_type_symbol
 _atom_site_label
 _atom_site_symmetry_multiplicity
 _atom_site_fract_x
 _atom_site_fract_y
 _atom_site_fract_z
 _atom_site_occupancy
  Si4+  Si0  1  0.83340328  0.25746142  0.34571740  1
  Si4+  Si1  1  0.66659672  0.75746142  0.15428260  1
  Si4+  Si2  1  0.16659672  0.74253858  0.65428260  1
  Si4+  Si3  1  0.33340328  0.24253858  0.84571740  1
  Si4+  Si4  1  0.00000000  0.97387900  0.75000000  1
  Si4+  Si5  1  0.00000000  0.02612100  0.25000000  1
  Si4+  Si6  1  0.33340328  0.75746142  0.34571740  1
  Si4+  Si7  1  0.16659672  0.25746142  0.15428260  1
  Si4+  Si8  1  0.66659672  0.24253858  0.65428260  1
  Si4+  Si9  1  0.83340328  0.74253858  0.84571740  1
  Si4+  Si10  1  0.50000000  0.47387900  0.75000000  1
  Si4+  Si11  1  0.50000000  0.52612100  0.25000000  1
  O2-  O12  1  0.06592934  0.77970784  0.68963121  1
  O2-  O13  1  0.93407066  0.77970784  0.81036879  1
  O2-  O14  1  0.93407066  0.22029216  0.31036879  1
  O2-  O15  1  0.06592934  0.22029216  0.18963121  1
  O2-  O16  1  0.89529804  0.16742126  0.56749170  1
  O2-  O17  1  0.10470196  0.16742126  0.93250830  1
  O2-  O18  1  0.20926158  0.42357584  0.68776695  1
  O2-  O19  1  0.29073842  0.92357584  0.81223305  1
  O2-  O20  1  0.79073842  0.57642416  0.31223305  1
  O2-  O21  1  0.70926158  0.07642416  0.18776695  1
  O2-  O22  1  0.89529804  0.83257874  0.06749170  1
  O2-  O23  1  0.10470196  0.83257874  0.43250830  1
  O2-  O24  1  0.56592934  0.27970784  0.68963121  1
  O2-  O25  1  0.43407066  0.27970784  0.81036879  1
  O2-  O26  1  0.43407066  0.72029216  0.31036879  1
  O2-  O27  1  0.56592934  0.72029216  0.18963121  1
  O2-  O28  1  0.39529804  0.66742126  0.56749170  1
  O2-  O29  1  0.60470196  0.66742126  0.93250830  1
  O2-  O30  1  0.70926158  0.92357584  0.68776695  1
  O2-  O31  1  0.79073842  0.42357584  0.81223305  1
  O2-  O32  1  0.29073842  0.07642416  0.31223305  1
  O2-  O33  1  0.20926158  0.57642416  0.18776695  1
  O2-  O34  1  0.39529804  0.33257874  0.06749170  1
  O2-  O35  1  0.60470196  0.33257874  0.43250830  1