# generated using pymatgen data_Zr3Zn3IrAu2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.27869104 _cell_length_b 7.27868918 _cell_length_c 3.50353720 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000291 _symmetry_Int_Tables_number 1 _chemical_formula_structural Zr3Zn3IrAu2 _chemical_formula_sum 'Zr3 Zn3 Ir1 Au2' _cell_volume 160.74734620 _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 0.41052071 0.02004719 0.49999900 1.0 Zr Zr1 1 0.97995281 0.39047352 0.49999900 1.0 Zr Zr2 1 0.60952748 0.58948029 0.49999900 1.0 Zn Zn3 1 0.72806803 0.99770577 0.00000000 1.0 Zn Zn4 1 0.26963774 0.27193297 0.00000000 1.0 Zn Zn5 1 0.00229423 0.73036226 0.00000000 1.0 Ir Ir6 1 0.66666700 0.33333300 0.00000000 1.0 Au Au7 1 0.33333300 0.66666600 0.00000000 1.0 Au Au8 1 0.00000000 0.00000000 0.49999900 1.0