# generated using pymatgen data_Sc12Si12Ru3Pt _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.02482688 _cell_length_b 10.23462781 _cell_length_c 11.68273204 _cell_angle_alpha 90.07393069 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sc12Si12Ru3Pt _chemical_formula_sum 'Sc12 Si12 Ru3 Pt1' _cell_volume 481.24176653 _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 0.87781474 0.02194213 1.0 Sc Sc1 1 0.25000000 0.62317759 0.51946843 1.0 Sc Sc2 1 0.75000000 0.12475268 0.98242903 1.0 Sc Sc3 1 0.75000000 0.37892440 0.47896788 1.0 Sc Sc4 1 0.25000000 0.92119865 0.60355987 1.0 Sc Sc5 1 0.25000000 0.57977077 0.10375780 1.0 Sc Sc6 1 0.75000000 0.07902258 0.39687938 1.0 Sc Sc7 1 0.75000000 0.42030292 0.89597768 1.0 Sc Sc8 1 0.25000000 0.65760307 0.79805218 1.0 Sc Sc9 1 0.25000000 0.83890011 0.29764350 1.0 Sc Sc10 1 0.75000000 0.34107277 0.20177789 1.0 Sc Sc11 1 0.75000000 0.15977736 0.69973337 1.0 Si Si12 1 0.25000000 0.01840047 0.82475589 1.0 Si Si13 1 0.25000000 0.48730163 0.32135849 1.0 Si Si14 1 0.75000000 0.98679841 0.17874879 1.0 Si Si15 1 0.75000000 0.51223374 0.67839425 1.0 Si Si16 1 0.25000000 0.25134823 0.84108732 1.0 Si Si17 1 0.25000000 0.24818922 0.34150926 1.0 Si Si18 1 0.75000000 0.74849406 0.15826352 1.0 Si Si19 1 0.75000000 0.74839177 0.65487708 1.0 Si Si20 1 0.25000000 0.19741948 0.54471058 1.0 Si Si21 1 0.25000000 0.30528131 0.04548007 1.0 Si Si22 1 0.75000000 0.80613451 0.45393543 1.0 Si Si23 1 0.75000000 0.69072288 0.95636700 1.0 Ru Ru24 1 0.25000000 0.39092590 0.67752985 1.0 Ru Ru25 1 0.25000000 0.10864093 0.17689044 1.0 Ru Ru26 1 0.75000000 0.60976805 0.32280942 1.0 Pt Pt27 1 0.75000000 0.88762976 0.82309448 1.0