# generated using pymatgen data_Ti16Pd5Rh3O4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.22707634 _cell_length_b 8.23588669 _cell_length_c 8.23588716 _cell_angle_alpha 60.00000208 _cell_angle_beta 59.96457075 _cell_angle_gamma 59.96457059 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ti16Pd5Rh3O4 _chemical_formula_sum 'Ti16 Pd5 Rh3 O4' _cell_volume 394.38329203 _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 Ti Ti0 1 0.11051741 0.62982720 0.62982720 1.0 Ti Ti1 1 0.63019663 0.11726348 0.62627094 1.0 Ti Ti2 1 0.63019663 0.62627094 0.11726348 1.0 Ti Ti3 1 0.63019663 0.62627094 0.62627094 1.0 Ti Ti4 1 0.81888995 0.81833839 0.18138583 1.0 Ti Ti5 1 0.17695262 0.18429183 0.81937778 1.0 Ti Ti6 1 0.81888995 0.18138583 0.81833839 1.0 Ti Ti7 1 0.17695262 0.81937778 0.18429183 1.0 Ti Ti8 1 0.17695262 0.81937778 0.81937778 1.0 Ti Ti9 1 0.81888995 0.18138583 0.18138583 1.0 Ti Ti10 1 0.42910801 0.42946742 0.07071179 1.0 Ti Ti11 1 0.07041570 0.06756024 0.43101253 1.0 Ti Ti12 1 0.42910801 0.07071179 0.42946742 1.0 Ti Ti13 1 0.07041570 0.43101253 0.06756024 1.0 Ti Ti14 1 0.07041570 0.43101253 0.43101253 1.0 Ti Ti15 1 0.42910801 0.07071179 0.07071179 1.0 Pd Pd16 1 0.77175648 0.40941417 0.40941417 1.0 Pd Pd17 1 0.41104575 0.76254462 0.41320432 1.0 Pd Pd18 1 0.41104575 0.41320432 0.76254462 1.0 Pd Pd19 1 0.41104575 0.41320432 0.41320432 1.0 Pd Pd20 1 0.47600915 0.84133062 0.84133062 1.0 Rh Rh21 1 0.84371729 0.46809316 0.84409478 1.0 Rh Rh22 1 0.84371729 0.84409478 0.46809316 1.0 Rh Rh23 1 0.84371729 0.84409478 0.84409478 1.0 O O24 1 0.62351236 0.12549521 0.12549521 1.0 O O25 1 0.12574025 0.62326195 0.12549890 1.0 O O26 1 0.12574025 0.12549890 0.62326195 1.0 O O27 1 0.12574025 0.12549890 0.12549890 1.0