# generated using pymatgen data_Ti2Pd3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.59806935 _cell_length_b 4.70005421 _cell_length_c 7.52805833 _cell_angle_alpha 108.19001076 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ti2Pd3 _chemical_formula_sum 'Ti4 Pd6' _cell_volume 154.55998805 _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 Ti Ti0 1 0.75000000 0.33628392 0.21527162 1.0 Ti Ti1 1 0.25000000 0.66371608 0.78472838 1.0 Ti Ti2 1 0.75000000 0.12101230 0.78472838 1.0 Ti Ti3 1 0.25000000 0.87898770 0.21527162 1.0 Pd Pd4 1 0.25000000 0.08889773 0.61077042 1.0 Pd Pd5 1 0.75000000 0.91110227 0.38922958 1.0 Pd Pd6 1 0.75000000 0.52187269 0.61077042 1.0 Pd Pd7 1 0.25000000 0.47812731 0.38922958 1.0 Pd Pd8 1 0.75000000 0.70214351 -0.00000000 1.0 Pd Pd9 1 0.25000000 0.29785649 0.00000000 1.0