# generated using pymatgen data_BaBi2(BrO)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 16.15571674 _cell_length_b 16.15571674 _cell_length_c 16.15571674 _cell_angle_alpha 165.60758697 _cell_angle_beta 165.60758697 _cell_angle_gamma 20.40818788 _symmetry_Int_Tables_number 1 _chemical_formula_structural BaBi2(BrO)2 _chemical_formula_sum 'Ba1 Bi2 Br2 O2' _cell_volume 260.49036434 _cell_formula_units_Z 1 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 Ba Ba0 1 0.59883400 0.59883400 0.00000000 1.0 Bi Bi1 1 0.42187000 0.42187000 0.00000000 1.0 Bi Bi2 1 0.00043300 0.00043300 0.00000000 1.0 Br Br3 1 0.14853300 0.14853300 0.00000000 1.0 Br Br4 1 0.87124400 0.87124400 0.00000000 1.0 O O5 1 0.46099300 0.96099300 0.50000000 1.0 O O6 1 0.96099300 0.46099300 0.50000000 1.0