# generated using pymatgen data_HfTiAu2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 11.19558026 _cell_length_b 11.19558026 _cell_length_c 11.19558026 _cell_angle_alpha 124.20402795 _cell_angle_beta 118.60264515 _cell_angle_gamma 87.65744477 _symmetry_Int_Tables_number 1 _chemical_formula_structural HfTiAu2 _chemical_formula_sum 'Hf1 Ti1 Au2' _cell_volume 967.27760873 _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 0.00000000 0.50000000 0.50000000 1.0 Ti Ti1 1 0.00000000 0.00000000 0.00000000 1.0 Au Au2 1 0.00000000 0.25036000 0.25036000 1.0 Au Au3 1 0.00000000 0.74964000 0.74964000 1.0