# generated using pymatgen data_Hf16Ir5Pd3O4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.70703781 _cell_length_b 8.70703736 _cell_length_c 8.70703843 _cell_angle_alpha 60.05820149 _cell_angle_beta 60.05820524 _cell_angle_gamma 60.05821002 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf16Ir5Pd3O4 _chemical_formula_sum 'Hf16 Ir5 Pd3 O4' _cell_volume 467.37861450 _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 0.12025374 0.62555091 0.62555091 1.0 Hf Hf1 1 0.62555091 0.12025374 0.62555091 1.0 Hf Hf2 1 0.62555091 0.62555091 0.12025374 1.0 Hf Hf3 1 0.62976222 0.62976222 0.62976222 1.0 Hf Hf4 1 0.81727754 0.81727754 0.18305861 1.0 Hf Hf5 1 0.18428193 0.18428193 0.81527910 1.0 Hf Hf6 1 0.81727754 0.18305861 0.81727754 1.0 Hf Hf7 1 0.18428193 0.81527910 0.18428193 1.0 Hf Hf8 1 0.18305861 0.81727754 0.81727754 1.0 Hf Hf9 1 0.81527910 0.18428193 0.18428193 1.0 Hf Hf10 1 0.43543880 0.43543880 0.06683618 1.0 Hf Hf11 1 0.06267856 0.06267856 0.43679557 1.0 Hf Hf12 1 0.43543880 0.06683618 0.43543880 1.0 Hf Hf13 1 0.06267856 0.43679557 0.06267856 1.0 Hf Hf14 1 0.06683618 0.43543880 0.43543880 1.0 Hf Hf15 1 0.43679557 0.06267856 0.06267856 1.0 Ir Ir16 1 0.40230569 0.40230569 0.40230569 1.0 Ir Ir17 1 0.45956644 0.84849142 0.84849142 1.0 Ir Ir18 1 0.84849142 0.45956644 0.84849142 1.0 Ir Ir19 1 0.84849142 0.84849142 0.45956644 1.0 Ir Ir20 1 0.84648955 0.84648955 0.84648955 1.0 Pd Pd21 1 0.77689983 0.40861323 0.40861323 1.0 Pd Pd22 1 0.40861323 0.77689983 0.40861323 1.0 Pd Pd23 1 0.40861323 0.40861323 0.77689983 1.0 O O24 1 0.62279556 0.12505549 0.12505549 1.0 O O25 1 0.12505549 0.62279556 0.12505549 1.0 O O26 1 0.12505549 0.12505549 0.62279556 1.0 O O27 1 0.12518076 0.12518076 0.12518076 1.0