# generated using pymatgen data_Hf4ReMoIr2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.52635467 _cell_length_b 4.60406368 _cell_length_c 9.19936987 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf4ReMoIr2 _chemical_formula_sum 'Hf8 Re2 Mo2 Ir4' _cell_volume 276.42038892 _cell_formula_units_Z 2 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 0.00021586 0.75000100 0.12496584 1.0 Hf Hf1 1 0.49968735 0.75000100 0.12497067 1.0 Hf Hf2 1 0.99968735 0.25000000 0.37502933 1.0 Hf Hf3 1 0.50021686 0.25000000 0.37503516 1.0 Hf Hf4 1 0.50040044 0.75000100 0.62490581 1.0 Hf Hf5 1 0.99969469 0.75000100 0.62490761 1.0 Hf Hf6 1 0.49969569 0.25000000 0.87509239 1.0 Hf Hf7 1 0.00040044 0.25000000 0.87509419 1.0 Re Re8 1 0.75002976 0.25000000 0.62579517 1.0 Re Re9 1 0.25002876 0.75000100 0.87420483 1.0 Mo Mo10 1 0.74996707 0.25000000 0.12425695 1.0 Mo Mo11 1 0.24996807 0.75000100 0.37574405 1.0 Ir Ir12 1 0.24996233 0.25000000 0.12435961 1.0 Ir Ir13 1 0.74996333 0.75000100 0.37563939 1.0 Ir Ir14 1 0.25004151 0.25000000 0.62577345 1.0 Ir Ir15 1 0.75004151 0.75000100 0.87422655 1.0