# generated using pymatgen data_Nd4ErIrPt2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 11.29365232 _cell_length_b 11.29365232 _cell_length_c 6.45473934 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nd4ErIrPt2 _chemical_formula_sum 'Nd16 Er4 Ir4 Pt8' _cell_volume 823.27994572 _cell_formula_units_Z 4 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 0.29171032 0.08710278 0.37679431 1.0 Nd Nd1 1 0.29171032 0.91289722 0.87679431 1.0 Nd Nd2 1 0.70828968 0.08710278 0.87679431 1.0 Nd Nd3 1 0.70828968 0.91289722 0.37679431 1.0 Nd Nd4 1 0.58710278 0.79171032 0.87679431 1.0 Nd Nd5 1 0.58710278 0.20828968 0.37679431 1.0 Nd Nd6 1 0.41289722 0.79171032 0.37679431 1.0 Nd Nd7 1 0.41289722 0.20828968 0.87679431 1.0 Nd Nd8 1 0.20828968 0.41289722 0.62320569 1.0 Nd Nd9 1 0.20828968 0.58710278 0.12320569 1.0 Nd Nd10 1 0.79171032 0.41289722 0.12320569 1.0 Nd Nd11 1 0.79171032 0.58710278 0.62320569 1.0 Nd Nd12 1 0.91289722 0.70828968 0.12320569 1.0 Nd Nd13 1 0.91289722 0.29171032 0.62320569 1.0 Nd Nd14 1 0.08710278 0.70828968 0.62320569 1.0 Nd Nd15 1 0.08710278 0.29171032 0.12320569 1.0 Er Er16 1 0.00000000 0.00000000 0.50000000 1.0 Er Er17 1 0.00000000 0.00000000 0.00000000 1.0 Er Er18 1 0.50000000 0.50000000 0.00000000 1.0 Er Er19 1 0.50000000 0.50000000 0.50000000 1.0 Ir Ir20 1 0.50000000 0.00000000 0.11604340 1.0 Ir Ir21 1 0.50000000 0.00000000 0.61604340 1.0 Ir Ir22 1 0.00000000 0.50000000 0.88395660 1.0 Ir Ir23 1 0.00000000 0.50000000 0.38395660 1.0 Pt Pt24 1 0.85334707 0.14665293 0.25000000 1.0 Pt Pt25 1 0.85334707 0.85334707 0.75000000 1.0 Pt Pt26 1 0.14665293 0.14665293 0.75000000 1.0 Pt Pt27 1 0.14665293 0.85334707 0.25000000 1.0 Pt Pt28 1 0.64665293 0.35334707 0.75000000 1.0 Pt Pt29 1 0.64665293 0.64665293 0.25000000 1.0 Pt Pt30 1 0.35334707 0.35334707 0.25000000 1.0 Pt Pt31 1 0.35334707 0.64665293 0.75000000 1.0