# generated using pymatgen data_Sc20Zn3Cd3Ni2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.93069499 _cell_length_b 8.93069513 _cell_length_c 8.81900305 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99998838 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sc20Zn3Cd3Ni2 _chemical_formula_sum 'Sc20 Zn3 Cd3 Ni2' _cell_volume 609.14501732 _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 0.00000000 0.00000000 0.47670787 1.0 Sc Sc1 1 0.00000000 0.00000000 0.02329213 1.0 Sc Sc2 1 0.54284559 0.45715441 0.25000000 1.0 Sc Sc3 1 0.54284559 0.08568919 0.25000000 1.0 Sc Sc4 1 0.91431081 0.45715441 0.25000000 1.0 Sc Sc5 1 0.45776257 0.54223743 0.75000000 1.0 Sc Sc6 1 0.45776257 0.91552513 0.75000000 1.0 Sc Sc7 1 0.08447487 0.54223743 0.75000000 1.0 Sc Sc8 1 0.20826522 0.79173478 0.43425460 1.0 Sc Sc9 1 0.20826522 0.41653144 0.43425460 1.0 Sc Sc10 1 0.58346856 0.79173478 0.43425460 1.0 Sc Sc11 1 0.79044240 0.20955760 0.56006660 1.0 Sc Sc12 1 0.79044240 0.58088480 0.56006660 1.0 Sc Sc13 1 0.41911520 0.20955760 0.56006660 1.0 Sc Sc14 1 0.79044240 0.20955760 0.93993340 1.0 Sc Sc15 1 0.79044240 0.58088480 0.93993340 1.0 Sc Sc16 1 0.41911520 0.20955760 0.93993340 1.0 Sc Sc17 1 0.20826522 0.79173478 0.06574540 1.0 Sc Sc18 1 0.20826522 0.41653144 0.06574540 1.0 Sc Sc19 1 0.58346856 0.79173478 0.06574540 1.0 Zn Zn20 1 0.87768265 0.12231735 0.25000000 1.0 Zn Zn21 1 0.87768265 0.75536629 0.25000000 1.0 Zn Zn22 1 0.24463371 0.12231735 0.25000000 1.0 Cd Cd23 1 0.11297067 0.88702933 0.75000000 1.0 Cd Cd24 1 0.11297067 0.22594034 0.75000000 1.0 Cd Cd25 1 0.77405966 0.88702933 0.75000000 1.0 Ni Ni26 1 0.33333300 0.66666700 0.25000000 1.0 Ni Ni27 1 0.66666700 0.33333300 0.75000000 1.0