# generated using pymatgen data_Sc12Si12RuRh3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.02448748 _cell_length_b 10.20444135 _cell_length_c 11.68235947 _cell_angle_alpha 90.02244339 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sc12Si12RuRh3 _chemical_formula_sum 'Sc12 Si12 Ru1 Rh3' _cell_volume 479.76697167 _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 0.87647593 0.02020923 1.0 Sc Sc1 1 0.25000000 0.62169562 0.52158083 1.0 Sc Sc2 1 0.75000000 0.12218127 0.97939962 1.0 Sc Sc3 1 0.75000000 0.37676110 0.48062041 1.0 Sc Sc4 1 0.25000000 0.92055261 0.60224467 1.0 Sc Sc5 1 0.25000000 0.57981274 0.10291187 1.0 Sc Sc6 1 0.75000000 0.07940314 0.39708287 1.0 Sc Sc7 1 0.75000000 0.42009303 0.89697202 1.0 Sc Sc8 1 0.25000000 0.66017785 0.79803413 1.0 Sc Sc9 1 0.25000000 0.84140604 0.29913656 1.0 Sc Sc10 1 0.75000000 0.34182598 0.20055779 1.0 Sc Sc11 1 0.75000000 0.15853749 0.70117420 1.0 Si Si12 1 0.25000000 0.01408596 0.82298291 1.0 Si Si13 1 0.25000000 0.48575201 0.32274677 1.0 Si Si14 1 0.75000000 0.98553091 0.17737668 1.0 Si Si15 1 0.75000000 0.51269388 0.67904252 1.0 Si Si16 1 0.25000000 0.25054401 0.84115655 1.0 Si Si17 1 0.25000000 0.24987405 0.34216293 1.0 Si Si18 1 0.75000000 0.75001237 0.15770963 1.0 Si Si19 1 0.75000000 0.75113414 0.65721300 1.0 Si Si20 1 0.25000000 0.19569720 0.54534040 1.0 Si Si21 1 0.25000000 0.30473871 0.04449378 1.0 Si Si22 1 0.75000000 0.80530100 0.45517451 1.0 Si Si23 1 0.75000000 0.69364829 0.95493980 1.0 Ru Ru24 1 0.25000000 0.39122867 0.67755921 1.0 Rh Rh25 1 0.25000000 0.11060085 0.17826979 1.0 Rh Rh26 1 0.75000000 0.61113821 0.32208196 1.0 Rh Rh27 1 0.75000000 0.88909493 0.82182436 1.0