# generated using pymatgen data_Lu4As6Ir4Ru3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.14314794 _cell_length_b 7.14666151 _cell_length_c 7.14666064 _cell_angle_alpha 109.40834672 _cell_angle_beta 109.51264940 _cell_angle_gamma 109.51263882 _symmetry_Int_Tables_number 1 _chemical_formula_structural Lu4As6Ir4Ru3 _chemical_formula_sum 'Lu4 As6 Ir4 Ru3' _cell_volume 280.78032340 _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 1.00000000 0.00018414 0.50004482 1.0 Lu Lu1 1 0.50000000 0.99994829 0.00005171 1.0 Lu Lu2 1 0.00000000 0.49995518 0.99981586 1.0 Lu Lu3 1 0.50000000 0.49994829 0.50005171 1.0 As As4 1 0.68137002 0.68453944 0.99683059 1.0 As As5 1 0.31187247 0.31530519 0.99656728 1.0 As As6 1 0.00000000 0.67954458 0.68635029 1.0 As As7 1 1.00000000 0.31364971 0.32045542 1.0 As As8 1 0.68812753 0.00343272 0.68469481 1.0 As As9 1 0.31862998 0.00316941 0.31546056 1.0 Ir Ir10 1 0.50000000 0.25051493 0.74948507 1.0 Ir Ir11 1 0.50000000 0.75051493 0.24948507 1.0 Ir Ir12 1 0.74892151 0.49941613 0.24950538 1.0 Ir Ir13 1 0.25107849 0.75049462 0.50058387 1.0 Ru Ru14 1 0.00000000 0.99976396 0.00023604 1.0 Ru Ru15 1 0.25075839 0.50018893 0.75056946 1.0 Ru Ru16 1 0.74924161 0.24943054 0.49981107 1.0