# generated using pymatgen
data_SiO2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.91496618
_cell_length_b   4.91496618
_cell_length_c   5.43130114
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SiO2
_chemical_formula_sum   'Si3 O6'
_cell_volume   113.62544098
_cell_formula_units_Z   3
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  0.53108859  0.53108859  0.00000000  1
  Si4+  Si1  1  0.00000000  0.46891141  0.66666667  1
  Si4+  Si2  1  0.46891141  0.00000000  0.33333333  1
  O2-  O3  1  0.26922311  0.41339429  0.78489098  1
  O2-  O4  1  0.58660571  0.85582882  0.11822431  1
  O2-  O5  1  0.14417118  0.73077689  0.45155765  1
  O2-  O6  1  0.41339429  0.26922311  0.21510902  1
  O2-  O7  1  0.73077689  0.14417118  0.54844235  1
  O2-  O8  1  0.85582882  0.58660571  0.88177569  1