# generated using pymatgen data_Bi8Pt5I3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.52772687 _cell_length_b 9.52772687 _cell_length_c 13.68822698 _cell_angle_alpha 67.83083350 _cell_angle_beta 67.83083350 _cell_angle_gamma 24.28909444 _symmetry_Int_Tables_number 1 _chemical_formula_structural Bi8Pt5I3 _chemical_formula_sum 'Bi8 Pt5 I3' _cell_volume 471.51689596 _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 Bi Bi0 1 0.89603300 0.89603300 0.47876800 1.0 Bi Bi1 1 0.10396700 0.10396700 0.52123200 1.0 Bi Bi2 1 0.32527300 0.32527300 0.72834600 1.0 Bi Bi3 1 0.67472700 0.67472700 0.27165400 1.0 Bi Bi4 1 0.48310600 0.48310600 0.78189300 1.0 Bi Bi5 1 0.51689400 0.51689400 0.21810700 1.0 Bi Bi6 1 0.68249200 0.68249200 0.97321500 1.0 Bi Bi7 1 0.31750800 0.31750800 0.02678500 1.0 Pt Pt8 1 0.50000000 0.50000000 0.50000000 1.0 Pt Pt9 1 0.94673500 0.94673500 0.65791300 1.0 Pt Pt10 1 0.05326500 0.05326500 0.34208700 1.0 Pt Pt11 1 0.84760100 0.84760100 0.87197200 1.0 Pt Pt12 1 0.15239900 0.15239900 0.12802800 1.0 I I13 1 0.00000000 0.00000000 0.00000000 1.0 I I14 1 0.68426100 0.68426100 0.67311800 1.0 I I15 1 0.31573900 0.31573900 0.32688200 1.0