# generated using pymatgen data_Nd4ErPb4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.33338439 _cell_length_b 8.44499585 _cell_length_c 16.06423602 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nd4ErPb4 _chemical_formula_sum 'Nd16 Er4 Pb16' _cell_volume 1130.52698147 _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 0.37592203 0.84430233 0.88110380 1.0 Nd Nd1 1 0.87592203 0.65569767 0.61889620 1.0 Nd Nd2 1 0.62407797 0.15569767 0.38110380 1.0 Nd Nd3 1 0.12407797 0.34430233 0.11889620 1.0 Nd Nd4 1 0.62407797 0.15569767 0.11889620 1.0 Nd Nd5 1 0.12407797 0.34430233 0.38110380 1.0 Nd Nd6 1 0.37592203 0.84430233 0.61889620 1.0 Nd Nd7 1 0.87592203 0.65569767 0.88110380 1.0 Nd Nd8 1 0.53379966 0.32341461 0.89918578 1.0 Nd Nd9 1 0.03379966 0.17658539 0.60081422 1.0 Nd Nd10 1 0.46620034 0.67658539 0.39918578 1.0 Nd Nd11 1 0.96620034 0.82341461 0.10081422 1.0 Nd Nd12 1 0.46620034 0.67658539 0.10081422 1.0 Nd Nd13 1 0.96620034 0.82341461 0.39918578 1.0 Nd Nd14 1 0.53379966 0.32341461 0.60081422 1.0 Nd Nd15 1 0.03379966 0.17658539 0.89918578 1.0 Er Er16 1 0.20949253 0.50299436 0.75000000 1.0 Er Er17 1 0.70949253 0.99700564 0.75000000 1.0 Er Er18 1 0.79050747 0.49700564 0.25000000 1.0 Er Er19 1 0.29050747 0.00299436 0.25000000 1.0 Pb Pb20 1 0.28005150 0.03120551 0.04700650 1.0 Pb Pb21 1 0.78005150 0.46879449 0.45299350 1.0 Pb Pb22 1 0.71994850 0.96879449 0.54700650 1.0 Pb Pb23 1 0.21994850 0.53120551 0.95299350 1.0 Pb Pb24 1 0.71994850 0.96879449 0.95299350 1.0 Pb Pb25 1 0.21994850 0.53120551 0.54700650 1.0 Pb Pb26 1 0.28005150 0.03120551 0.45299350 1.0 Pb Pb27 1 0.78005150 0.46879449 0.04700650 1.0 Pb Pb28 1 0.56964735 0.62804248 0.75000000 1.0 Pb Pb29 1 0.06964735 0.87195752 0.75000000 1.0 Pb Pb30 1 0.43035265 0.37195752 0.25000000 1.0 Pb Pb31 1 0.93035265 0.12804248 0.25000000 1.0 Pb Pb32 1 0.34573568 0.15409739 0.75000000 1.0 Pb Pb33 1 0.84573568 0.34590261 0.75000000 1.0 Pb Pb34 1 0.65426432 0.84590261 0.25000000 1.0 Pb Pb35 1 0.15426432 0.65409739 0.25000000 1.0