# generated using pymatgen data_Lu3In3NiIr2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.49396782 _cell_length_b 7.49396852 _cell_length_c 3.63695172 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999692 _symmetry_Int_Tables_number 1 _chemical_formula_structural Lu3In3NiIr2 _chemical_formula_sum 'Lu3 In3 Ni1 Ir2' _cell_volume 176.88535151 _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 0.59093346 0.00000000 0.00000000 1.0 Lu Lu1 1 0.00000000 0.59093346 0.00000000 1.0 Lu Lu2 1 0.40906654 0.40906654 0.00000000 1.0 In In3 1 0.25120714 0.00000000 0.50000000 1.0 In In4 1 0.00000000 0.25120714 0.50000000 1.0 In In5 1 0.74879286 0.74879286 0.50000000 1.0 Ni Ni6 1 0.00000000 0.00000000 0.00000000 1.0 Ir Ir7 1 0.33333300 0.66666700 0.50000000 1.0 Ir Ir8 1 0.66666700 0.33333300 0.50000000 1.0