# generated using pymatgen data_BaBi2(IO)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 13.07454034 _cell_length_b 13.07454034 _cell_length_c 13.07454034 _cell_angle_alpha 158.69044350 _cell_angle_beta 158.69044350 _cell_angle_gamma 30.31524766 _symmetry_Int_Tables_number 1 _chemical_formula_structural BaBi2(IO)2 _chemical_formula_sum 'Ba1 Bi2 I2 O2' _cell_volume 294.98012761 _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 0.59066600 0.59066600 0.00000000 1.0 Bi Bi1 1 0.97751900 0.97751900 0.00000000 1.0 Bi Bi2 1 0.43934000 0.43934000 0.00000000 1.0 I I3 1 0.71429700 0.71429700 0.00000000 1.0 I I4 1 0.11316600 0.11316600 0.00000000 1.0 O O5 1 0.46445600 0.96445600 0.50000000 1.0 O O6 1 0.96445600 0.46445600 0.50000000 1.0