# generated using pymatgen data_TbNd4Pb3Br _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.50834399 _cell_length_b 9.50834353 _cell_length_c 6.86473544 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99998798 _symmetry_Int_Tables_number 1 _chemical_formula_structural TbNd4Pb3Br _chemical_formula_sum 'Tb2 Nd8 Pb6 Br2' _cell_volume 537.48238849 _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 Tb Tb0 1 0.66666700 0.33333300 0.50000000 1.0 Tb Tb1 1 0.33333300 0.66666700 0.50000000 1.0 Nd Nd2 1 0.26576359 1.00000000 0.25131821 1.0 Nd Nd3 1 0.73423641 0.00000000 0.74868179 1.0 Nd Nd4 1 1.00000000 0.26576359 0.25131821 1.0 Nd Nd5 1 0.00000000 0.73423641 0.74868179 1.0 Nd Nd6 1 0.73423641 0.73423641 0.25131821 1.0 Nd Nd7 1 0.26576359 0.26576359 0.74868179 1.0 Nd Nd8 1 0.33333300 0.66666700 0.00000000 1.0 Nd Nd9 1 0.66666700 0.33333300 0.00000000 1.0 Pb Pb10 1 0.61122487 0.00000000 0.25404979 1.0 Pb Pb11 1 0.38877513 1.00000000 0.74595021 1.0 Pb Pb12 1 0.00000000 0.61122487 0.25404979 1.0 Pb Pb13 1 1.00000000 0.38877513 0.74595021 1.0 Pb Pb14 1 0.38877513 0.38877513 0.25404979 1.0 Pb Pb15 1 0.61122487 0.61122487 0.74595021 1.0 Br Br16 1 0.00000000 0.00000000 0.00000000 1.0 Br Br17 1 0.00000000 0.00000000 0.50000000 1.0