# generated using pymatgen data_Sc4P4IrRh3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.86971088 _cell_length_b 6.43486556 _cell_length_c 7.29789421 _cell_angle_alpha 90.05825571 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sc4P4IrRh3 _chemical_formula_sum 'Sc4 P4 Ir1 Rh3' _cell_volume 181.72527554 _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 Sc Sc0 1 0.25000000 0.02551227 0.82090809 1.0 Sc Sc1 1 0.25000000 0.52765271 0.67976220 1.0 Sc Sc2 1 0.75000000 0.97398963 0.17958858 1.0 Sc Sc3 1 0.75000000 0.47261091 0.31912674 1.0 P P4 1 0.25000000 0.77116633 0.37732394 1.0 P P5 1 0.25000000 0.26848487 0.12151265 1.0 P P6 1 0.75000000 0.22950768 0.62246795 1.0 P P7 1 0.75000000 0.73096707 0.87897385 1.0 Ir Ir8 1 0.25000000 0.15560489 0.44118063 1.0 Rh Rh9 1 0.25000000 0.65057388 0.06198205 1.0 Rh Rh10 1 0.75000000 0.84683411 0.55967678 1.0 Rh Rh11 1 0.75000000 0.34709365 0.93749653 1.0