# generated using pymatgen data_Y3Hf5Ir4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.51586488 _cell_length_b 6.89205438 _cell_length_c 8.25027467 _cell_angle_alpha 89.00673449 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Y3Hf5Ir4 _chemical_formula_sum 'Y3 Hf5 Ir4' _cell_volume 256.73955280 _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 Y Y0 1 0.25000000 0.48567717 0.18078274 1.0 Y Y1 1 0.75000000 0.01109036 0.67691861 1.0 Y Y2 1 0.75000000 0.51270978 0.82113766 1.0 Hf Hf3 1 0.25000000 0.98977966 0.32936920 1.0 Hf Hf4 1 0.25000000 0.35550848 0.57143839 1.0 Hf Hf5 1 0.25000000 0.85980830 0.93200463 1.0 Hf Hf6 1 0.75000000 0.64804409 0.42113476 1.0 Hf Hf7 1 0.75000000 0.13914639 0.08191413 1.0 Ir Ir8 1 0.25000000 0.23389419 0.90824509 1.0 Ir Ir9 1 0.25000000 0.74074931 0.57922846 1.0 Ir Ir10 1 0.75000000 0.76711084 0.09412470 1.0 Ir Ir11 1 0.75000000 0.25647941 0.40369964 1.0