# generated using pymatgen data_Nd6Mg4IrPd12 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.41163560 _cell_length_b 8.41163624 _cell_length_c 8.41163607 _cell_angle_alpha 109.47122022 _cell_angle_beta 109.47122176 _cell_angle_gamma 109.47122467 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nd6Mg4IrPd12 _chemical_formula_sum 'Nd6 Mg4 Ir1 Pd12' _cell_volume 458.16244983 _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 0.70127240 0.70127240 1.00000000 1.0 Nd Nd1 1 0.29872760 0.00000000 0.29872760 1.0 Nd Nd2 1 0.00000000 0.29872760 0.29872760 1.0 Nd Nd3 1 0.29872760 0.29872760 0.00000000 1.0 Nd Nd4 1 0.70127240 1.00000000 0.70127240 1.0 Nd Nd5 1 1.00000000 0.70127240 0.70127240 1.0 Mg Mg6 1 0.00000000 0.00000000 0.50000000 1.0 Mg Mg7 1 0.00000000 0.50000000 0.00000000 1.0 Mg Mg8 1 0.50000000 0.00000000 0.00000000 1.0 Mg Mg9 1 0.50000000 0.50000000 0.50000000 1.0 Ir Ir10 1 0.00000000 0.00000000 0.00000000 1.0 Pd Pd11 1 0.33602565 0.33602565 0.67205330 1.0 Pd Pd12 1 0.66397435 0.00000000 0.33602565 1.0 Pd Pd13 1 0.00000000 0.66397435 0.33602565 1.0 Pd Pd14 1 0.66397435 0.33602565 0.00000000 1.0 Pd Pd15 1 0.33602565 0.67205330 0.33602565 1.0 Pd Pd16 1 1.00000000 0.33602565 0.66397435 1.0 Pd Pd17 1 0.33602565 0.66397435 1.00000000 1.0 Pd Pd18 1 0.33602565 1.00000000 0.66397435 1.0 Pd Pd19 1 0.67205330 0.33602565 0.33602565 1.0 Pd Pd20 1 0.66397435 0.66397435 0.32794670 1.0 Pd Pd21 1 0.66397435 0.32794670 0.66397435 1.0 Pd Pd22 1 0.32794670 0.66397435 0.66397435 1.0