# generated using pymatgen data_Ti8Ir3Pd _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.34445071 _cell_length_b 9.83102072 _cell_length_c 4.34469090 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ti8Ir3Pd _chemical_formula_sum 'Ti8 Ir3 Pd1' _cell_volume 185.56342075 _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 0.41668690 0.16299414 0.00000000 1.0 Ti Ti1 1 0.91662814 0.34018509 0.00000000 1.0 Ti Ti2 1 0.91662814 0.65981491 0.00000000 1.0 Ti Ti3 1 0.41668690 0.83700686 0.00000000 1.0 Ti Ti4 1 0.91664918 0.16300205 0.50000100 1.0 Ti Ti5 1 0.41662959 0.33827271 0.50000100 1.0 Ti Ti6 1 0.41662959 0.66172729 0.50000100 1.0 Ti Ti7 1 0.91664918 0.83699895 0.50000100 1.0 Ir Ir8 1 0.41664925 0.50000000 0.00000000 1.0 Ir Ir9 1 0.41667894 0.00000000 0.50000100 1.0 Ir Ir10 1 0.91664443 0.50000000 0.50000100 1.0 Pd Pd11 1 0.91678376 0.00000000 0.00000000 1.0