# generated using pymatgen data_Hf8Mo3Ir4Ru _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.52805859 _cell_length_b 4.60070327 _cell_length_c 9.19853385 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00003835 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf8Mo3Ir4Ru _chemical_formula_sum 'Hf8 Mo3 Ir4 Ru1' _cell_volume 276.26564299 _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 Hf Hf0 1 0.00118926 0.75000000 0.12500206 1.0 Hf Hf1 1 0.49880338 0.75000000 0.12500201 1.0 Hf Hf2 1 0.00078232 0.25000100 0.37552689 1.0 Hf Hf3 1 0.49921383 0.25000100 0.37552655 1.0 Hf Hf4 1 0.49957889 0.75000000 0.62499712 1.0 Hf Hf5 1 0.00042712 0.75000000 0.62499734 1.0 Hf Hf6 1 0.49921854 0.25000100 0.87447222 1.0 Hf Hf7 1 0.00078816 0.25000100 0.87447197 1.0 Mo Mo8 1 0.24999812 0.75000000 0.37302762 1.0 Mo Mo9 1 0.75000248 0.25000100 0.62499494 1.0 Mo Mo10 1 0.25000232 0.75000000 0.87697459 1.0 Ir Ir11 1 0.24999639 0.25000100 0.12500259 1.0 Ir Ir12 1 0.74999846 0.75000000 0.37247100 1.0 Ir Ir13 1 0.25000368 0.25000100 0.62499663 1.0 Ir Ir14 1 0.75000168 0.75000000 0.87752845 1.0 Ru Ru15 1 0.74999637 0.25000100 0.12500901 1.0