# generated using pymatgen data_Nd6IrAu _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.67672877 _cell_length_b 7.30434997 _cell_length_c 10.06955880 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nd6IrAu _chemical_formula_sum 'Nd12 Ir2 Au2' _cell_volume 491.08396022 _cell_formula_units_Z 2 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 Nd Nd0 1 0.66828804 0.16596104 0.43732100 1.0 Nd Nd1 1 0.16828804 0.33403896 0.56267900 1.0 Nd Nd2 1 0.81774785 0.68454727 0.05974559 1.0 Nd Nd3 1 0.31774785 0.81545273 0.94025441 1.0 Nd Nd4 1 0.14762153 0.01681253 0.25000000 1.0 Nd Nd5 1 0.64762153 0.48318747 0.75000000 1.0 Nd Nd6 1 0.37277352 0.53737573 0.25000000 1.0 Nd Nd7 1 0.87277352 0.96262427 0.75000000 1.0 Nd Nd8 1 0.66828804 0.16596104 0.06267900 1.0 Nd Nd9 1 0.16828804 0.33403896 0.93732100 1.0 Nd Nd10 1 0.81774785 0.68454727 0.44025441 1.0 Nd Nd11 1 0.31774785 0.81545273 0.55974559 1.0 Ir Ir12 1 0.06559823 0.61725386 0.75000000 1.0 Ir Ir13 1 0.56559823 0.88274614 0.25000000 1.0 Au Au14 1 0.44193294 0.11319089 0.75000000 1.0 Au Au15 1 0.94193294 0.38680911 0.25000000 1.0