# generated using pymatgen data_Ti3Pd5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.27980186 _cell_length_b 3.27980186 _cell_length_c 11.45500814 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ti3Pd5 _chemical_formula_sum 'Ti3 Pd5' _cell_volume 123.22267082 _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 0.50000000 0.50000000 0.13784446 1.0 Ti Ti1 1 0.50000000 0.50000000 0.86222945 1.0 Ti Ti2 1 0.00000000 -0.00000000 0.49999627 1.0 Pd Pd3 1 0.00000000 -0.00000000 0.24233376 1.0 Pd Pd4 1 0.50000000 0.50000000 0.61960923 1.0 Pd Pd5 1 0.50000000 0.50000000 0.38030966 1.0 Pd Pd6 1 -0.00000000 -0.00000000 0.75771973 1.0 Pd Pd7 1 0.00000000 -0.00000000 -0.00004256 1.0