# generated using pymatgen data_Nd5BiPb2Br _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.60229739 _cell_length_b 9.60229767 _cell_length_c 6.86105599 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.43054469 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nd5BiPb2Br _chemical_formula_sum 'Nd10 Bi2 Pb4 Br2' _cell_volume 545.47060253 _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 0.26967429 0.99589700 0.75000000 1.0 Nd Nd1 1 0.73032571 0.00410300 0.25000000 1.0 Nd Nd2 1 0.99589700 0.26967429 0.75000000 1.0 Nd Nd3 1 0.00410300 0.73032571 0.25000000 1.0 Nd Nd4 1 0.73164773 0.73164773 0.75000000 1.0 Nd Nd5 1 0.26835227 0.26835227 0.25000000 1.0 Nd Nd6 1 0.33097302 0.66902698 0.50000000 1.0 Nd Nd7 1 0.66902698 0.33097302 0.50000000 1.0 Nd Nd8 1 0.66902698 0.33097302 0.00000000 1.0 Nd Nd9 1 0.33097302 0.66902698 0.00000000 1.0 Bi Bi10 1 0.38527069 0.38527069 0.75000000 1.0 Bi Bi11 1 0.61472931 0.61472931 0.25000000 1.0 Pb Pb12 1 0.61238604 0.99769979 0.75000000 1.0 Pb Pb13 1 0.38761396 0.00230021 0.25000000 1.0 Pb Pb14 1 0.99769979 0.61238604 0.75000000 1.0 Pb Pb15 1 0.00230021 0.38761396 0.25000000 1.0 Br Br16 1 0.00000000 0.00000000 0.50000000 1.0 Br Br17 1 0.00000000 0.00000000 0.00000000 1.0