# generated using pymatgen data_Sc3Sn3Rh2Au _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.55562986 _cell_length_b 7.55563063 _cell_length_c 7.03093408 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000526 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sc3Sn3Rh2Au _chemical_formula_sum 'Sc6 Sn6 Rh4 Au2' _cell_volume 347.60421010 _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 Sc Sc0 1 0.38651623 0.98688885 0.25000000 1.0 Sc Sc1 1 0.60037162 0.61348377 0.25000000 1.0 Sc Sc2 1 0.01311115 0.39962838 0.25000000 1.0 Sc Sc3 1 0.38095230 0.97594467 0.75000000 1.0 Sc Sc4 1 0.59499237 0.61904770 0.75000000 1.0 Sc Sc5 1 0.02405533 0.40500763 0.75000000 1.0 Sn Sn6 1 0.72906172 0.00004858 0.00085560 1.0 Sn Sn7 1 0.27098686 0.27093828 0.49914440 1.0 Sn Sn8 1 0.99995142 0.72901314 0.49914440 1.0 Sn Sn9 1 0.99995142 0.72901314 0.00085560 1.0 Sn Sn10 1 0.27098686 0.27093828 0.00085560 1.0 Sn Sn11 1 0.72906172 0.00004858 0.49914440 1.0 Rh Rh12 1 0.33333300 0.66666700 0.00743474 1.0 Rh Rh13 1 0.33333300 0.66666700 0.49256526 1.0 Rh Rh14 1 0.00000000 0.00000000 0.25000000 1.0 Rh Rh15 1 0.00000000 0.00000000 0.75000000 1.0 Au Au16 1 0.66666700 0.33333300 0.98197555 1.0 Au Au17 1 0.66666700 0.33333300 0.51802445 1.0