# generated using pymatgen data_Er3Hf5Ir4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.50754631 _cell_length_b 6.82642325 _cell_length_c 8.19982783 _cell_angle_alpha 90.89958101 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Er3Hf5Ir4 _chemical_formula_sum 'Er3 Hf5 Ir4' _cell_volume 252.28103949 _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 Er Er0 1 0.25000000 0.48850845 0.17608235 1.0 Er Er1 1 0.75000000 0.01438641 0.67988356 1.0 Er Er2 1 0.25000000 0.98755946 0.32226543 1.0 Hf Hf3 1 0.75000000 0.64280927 0.42873842 1.0 Hf Hf4 1 0.25000000 0.36025978 0.58100261 1.0 Hf Hf5 1 0.75000000 0.14425219 0.07367947 1.0 Hf Hf6 1 0.25000000 0.85107046 0.92130229 1.0 Hf Hf7 1 0.75000000 0.50868319 0.82909510 1.0 Ir Ir8 1 0.75000000 0.26344226 0.40834018 1.0 Ir Ir9 1 0.25000000 0.73737754 0.59284217 1.0 Ir Ir10 1 0.75000000 0.75622420 0.08214353 1.0 Ir Ir11 1 0.25000000 0.24542881 0.90462189 1.0