# generated using pymatgen data_Lu5Sc3Ir4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.26909825 _cell_length_b 7.02506633 _cell_length_c 8.55669703 _cell_angle_alpha 89.55048499 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Lu5Sc3Ir4 _chemical_formula_sum 'Lu5 Sc3 Ir4' _cell_volume 256.61342193 _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 0.75000000 0.64534541 0.42734206 1.0 Lu Lu1 1 0.25000000 0.48120559 0.16116668 1.0 Lu Lu2 1 0.25000000 0.99344476 0.33433559 1.0 Lu Lu3 1 0.75000000 0.51575335 0.83026430 1.0 Lu Lu4 1 0.75000000 0.01881766 0.67265152 1.0 Sc Sc5 1 0.25000000 0.85786661 0.93176193 1.0 Sc Sc6 1 0.25000000 0.35563413 0.57150989 1.0 Sc Sc7 1 0.75000000 0.14010187 0.06904968 1.0 Ir Ir8 1 0.25000000 0.24365203 0.89417004 1.0 Ir Ir9 1 0.25000000 0.74832431 0.61122299 1.0 Ir Ir10 1 0.75000000 0.75030139 0.09863185 1.0 Ir Ir11 1 0.75000000 0.24955488 0.39789245 1.0