# generated using pymatgen data_Nd2Cu9Ir _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.19942532 _cell_length_b 5.19942548 _cell_length_c 8.07796066 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 122.97495988 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nd2Cu9Ir _chemical_formula_sum 'Nd2 Cu9 Ir1' _cell_volume 183.20066172 _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 Nd Nd0 1 0.00000000 0.00000000 0.73527453 1.0 Nd Nd1 1 0.00000000 0.00000000 0.26472547 1.0 Cu Cu2 1 0.67336170 0.32663830 0.75362859 1.0 Cu Cu3 1 0.67336170 0.32663830 0.24637141 1.0 Cu Cu4 1 0.50000000 0.50000000 0.00000000 1.0 Cu Cu5 1 0.32663830 0.67336170 0.75362859 1.0 Cu Cu6 1 0.50000000 0.00000000 0.50000000 1.0 Cu Cu7 1 0.00000000 0.50000000 0.00000000 1.0 Cu Cu8 1 0.50000000 0.00000000 0.00000000 1.0 Cu Cu9 1 0.32663830 0.67336170 0.24637141 1.0 Cu Cu10 1 0.00000000 0.50000000 0.50000000 1.0 Ir Ir11 1 0.50000000 0.50000000 0.50000000 1.0