# generated using pymatgen data_ZrAlAu2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.19934600 _cell_length_b 3.19934600 _cell_length_c 7.11271500 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural ZrAlAu2 _chemical_formula_sum 'Zr1 Al1 Au2' _cell_volume 72.80443366 _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 Zr Zr0 1 0.50000000 0.50000000 0.50000000 1.0 Al Al1 1 0.50000000 0.50000000 0.00000000 1.0 Au Au2 1 0.00000000 0.00000000 0.78059200 1.0 Au Au3 1 0.00000000 0.00000000 0.21940800 1.0