# generated using pymatgen data_Lu4As6Ir5Ru2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.15389347 _cell_length_b 7.15389347 _cell_length_c 7.15389342 _cell_angle_alpha 109.45026855 _cell_angle_beta 109.51311591 _cell_angle_gamma 109.45027207 _symmetry_Int_Tables_number 1 _chemical_formula_structural Lu4As6Ir5Ru2 _chemical_formula_sum 'Lu4 As6 Ir5 Ru2' _cell_volume 281.84180400 _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 0.00043483 0.00086866 0.50043483 1.0 Lu Lu1 1 0.49956517 0.99913134 0.99956517 1.0 Lu Lu2 1 0.00043483 0.50000000 0.99956517 1.0 Lu Lu3 1 0.49956517 0.50000000 0.50043483 1.0 As As4 1 0.68067779 0.68373626 0.99694052 1.0 As As5 1 0.31320526 0.31626374 0.99694052 1.0 As As6 1 0.00305948 0.68373626 0.68679474 1.0 As As7 1 0.00305948 0.31626374 0.31932221 1.0 As As8 1 0.68571744 0.00000000 0.68571744 1.0 As As9 1 0.31428256 1.00000000 0.31428256 1.0 Ir Ir10 1 0.74938190 0.24933568 0.50004522 1.0 Ir Ir11 1 0.49995478 0.24933568 0.74929047 1.0 Ir Ir12 1 0.49995478 0.75066432 0.25061810 1.0 Ir Ir13 1 0.75000000 0.50000000 0.25000000 1.0 Ir Ir14 1 0.25070953 0.75066432 0.50004522 1.0 Ru Ru15 1 0.00000000 0.00000000 0.00000000 1.0 Ru Ru16 1 0.25000000 0.50000000 0.75000000 1.0