# generated using pymatgen data_Zr3Al3CoAu2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.71857804 _cell_length_b 6.71857702 _cell_length_c 4.04435644 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999037 _symmetry_Int_Tables_number 1 _chemical_formula_structural Zr3Al3CoAu2 _chemical_formula_sum 'Zr3 Al3 Co1 Au2' _cell_volume 158.10105375 _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 0.39132724 0.39132724 0.50000000 1.0 Zr Zr1 1 0.60867276 1.00000000 0.50000000 1.0 Zr Zr2 1 1.00000000 0.60867276 0.50000000 1.0 Al Al3 1 0.76565422 0.76565422 0.00000000 1.0 Al Al4 1 0.23434578 0.00000000 0.00000000 1.0 Al Al5 1 0.00000000 0.23434578 0.00000000 1.0 Co Co6 1 0.00000000 0.00000000 0.50000000 1.0 Au Au7 1 0.66666700 0.33333300 0.00000000 1.0 Au Au8 1 0.33333300 0.66666700 0.00000000 1.0