# generated using pymatgen data_Sc6Sn6Ru11Rh _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.51237961 _cell_length_b 6.40818204 _cell_length_c 13.53431109 _cell_angle_alpha 90.00001424 _cell_angle_beta 90.00053276 _cell_angle_gamma 89.99981699 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sc6Sn6Ru11Rh _chemical_formula_sum 'Sc6 Sn6 Ru11 Rh1' _cell_volume 391.36016942 _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 0.99999034 0.00099163 0.00075297 1.0 Sc Sc1 1 0.50014196 0.49985215 0.16709552 1.0 Sc Sc2 1 0.00017644 0.99932836 0.33337391 1.0 Sc Sc3 1 0.49999370 0.49984581 0.49961166 1.0 Sc Sc4 1 0.99984586 0.00098919 0.66587179 1.0 Sc Sc5 1 0.49985646 0.49909679 0.83329418 1.0 Sn Sn6 1 0.99999432 0.49817715 0.00128908 1.0 Sn Sn7 1 0.50013056 0.00000413 0.16647378 1.0 Sn Sn8 1 0.00017034 0.50029095 0.33335411 1.0 Sn Sn9 1 0.49999932 0.00000102 0.50021630 1.0 Sn Sn10 1 0.99984759 0.49817591 0.66535291 1.0 Sn Sn11 1 0.49986914 0.00319251 0.83331121 1.0 Ru Ru12 1 0.49998747 0.25008709 0.99938002 1.0 Ru Ru13 1 0.49999495 0.75003517 0.99922317 1.0 Ru Ru14 1 0.00012719 0.24933321 0.16686828 1.0 Ru Ru15 1 0.00014435 0.74978780 0.16607510 1.0 Ru Ru16 1 0.50017528 0.24941074 0.33337210 1.0 Ru Ru17 1 0.50017425 0.75059898 0.33337205 1.0 Ru Ru18 1 0.99999329 0.24934109 0.49983345 1.0 Ru Ru19 1 0.99999306 0.74978182 0.50063143 1.0 Ru Ru20 1 0.49983872 0.25006908 0.66724928 1.0 Ru Ru21 1 0.49984622 0.75004003 0.66740523 1.0 Ru Ru22 1 0.99986094 0.25156267 0.83329429 1.0 Rh Rh23 1 0.99985126 0.75000472 0.83329521 1.0