# generated using pymatgen data_Lu11Sc(Si3Rh)4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.12185262 _cell_length_b 10.45145033 _cell_length_c 12.00101335 _cell_angle_alpha 89.97528712 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Lu11Sc(Si3Rh)4 _chemical_formula_sum 'Lu11 Sc1 Si12 Rh4' _cell_volume 516.99566090 _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 Lu Lu0 1 0.25000000 0.87997349 0.01979440 1.0 Lu Lu1 1 0.25000000 0.62052020 0.52014905 1.0 Lu Lu2 1 0.75000000 0.12073383 0.97772910 1.0 Lu Lu3 1 0.75000000 0.37789271 0.48100731 1.0 Lu Lu4 1 0.25000000 0.92175879 0.60216696 1.0 Lu Lu5 1 0.25000000 0.57997195 0.10353295 1.0 Lu Lu6 1 0.75000000 0.07907479 0.39909117 1.0 Lu Lu7 1 0.75000000 0.41977920 0.89620039 1.0 Lu Lu8 1 0.25000000 0.66130393 0.79975542 1.0 Lu Lu9 1 0.25000000 0.84087797 0.30074333 1.0 Lu Lu10 1 0.75000000 0.33752483 0.19999650 1.0 Sc Sc11 1 0.75000000 0.16022145 0.70100700 1.0 Si Si12 1 0.25000000 0.01533867 0.82161717 1.0 Si Si13 1 0.25000000 0.48494396 0.32214324 1.0 Si Si14 1 0.75000000 0.98684349 0.17741032 1.0 Si Si15 1 0.75000000 0.51475064 0.67772874 1.0 Si Si16 1 0.25000000 0.24703942 0.83827511 1.0 Si Si17 1 0.25000000 0.25089420 0.34404398 1.0 Si Si18 1 0.75000000 0.75248146 0.15823745 1.0 Si Si19 1 0.75000000 0.74841243 0.65755955 1.0 Si Si20 1 0.25000000 0.19737144 0.54835645 1.0 Si Si21 1 0.25000000 0.30193255 0.04135318 1.0 Si Si22 1 0.75000000 0.80119426 0.45695650 1.0 Si Si23 1 0.75000000 0.69810535 0.95671434 1.0 Rh Rh24 1 0.25000000 0.39028480 0.68055910 1.0 Rh Rh25 1 0.25000000 0.11102785 0.18072343 1.0 Rh Rh26 1 0.75000000 0.60935126 0.31902515 1.0 Rh Rh27 1 0.75000000 0.89039307 0.81812173 1.0