# generated using pymatgen
data_HgBiO3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.12275912
_cell_length_b   6.12275912
_cell_length_c   6.12275911
_cell_angle_alpha   57.98285020
_cell_angle_beta   57.98285020
_cell_angle_gamma   57.98284921
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HgBiO3
_chemical_formula_sum   'Hg2 Bi2 O6'
_cell_volume   154.79235641
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
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
  Hg  Hg0  1  0.75000000  0.75000000  0.75000000  1.0
  Hg  Hg1  1  0.25000000  0.25000000  0.25000000  1.0
  Bi  Bi2  1  0.50000000  0.50000000  0.50000000  1.0
  Bi  Bi3  1  0.00000000  0.00000000  0.00000000  1.0
  O  O4  1  0.25000000  0.62684100  0.87315900  1.0
  O  O5  1  0.12684100  0.75000000  0.37315900  1.0
  O  O6  1  0.37315900  0.12684100  0.75000000  1.0
  O  O7  1  0.62684100  0.87315900  0.25000000  1.0
  O  O8  1  0.87315900  0.25000000  0.62684100  1.0
  O  O9  1  0.75000000  0.37315900  0.12684100  1.0