# generated using pymatgen data_Tb2Sm3Pb3Br _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.35241055 _cell_length_b 9.35241020 _cell_length_c 6.79861072 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999086 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tb2Sm3Pb3Br _chemical_formula_sum 'Tb4 Sm6 Pb6 Br2' _cell_volume 514.98900412 _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 0.33333300 0.66666700 0.00000000 1.0 Tb Tb1 1 0.66666700 0.33333300 0.00000000 1.0 Tb Tb2 1 0.66666700 0.33333300 0.50000000 1.0 Tb Tb3 1 0.33333300 0.66666700 0.50000000 1.0 Sm Sm4 1 0.26878391 0.00000000 0.25000000 1.0 Sm Sm5 1 0.73121609 1.00000000 0.75000000 1.0 Sm Sm6 1 0.00000000 0.26878391 0.25000000 1.0 Sm Sm7 1 1.00000000 0.73121609 0.75000000 1.0 Sm Sm8 1 0.73121609 0.73121609 0.25000000 1.0 Sm Sm9 1 0.26878391 0.26878391 0.75000000 1.0 Pb Pb10 1 0.61111919 1.00000000 0.25000000 1.0 Pb Pb11 1 0.38888081 0.00000000 0.75000000 1.0 Pb Pb12 1 1.00000000 0.61111919 0.25000000 1.0 Pb Pb13 1 0.00000000 0.38888081 0.75000000 1.0 Pb Pb14 1 0.38888081 0.38888081 0.25000000 1.0 Pb Pb15 1 0.61111919 0.61111919 0.75000000 1.0 Br Br16 1 0.00000000 0.00000000 0.00000000 1.0 Br Br17 1 0.00000000 0.00000000 0.50000000 1.0