# generated using pymatgen data_Nd10Sn5BiBr2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.51594227 _cell_length_b 9.51594280 _cell_length_c 6.87468770 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.24116888 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nd10Sn5BiBr2 _chemical_formula_sum 'Nd10 Sn5 Bi1 Br2' _cell_volume 537.80727973 _cell_formula_units_Z 1 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 0.66810197 0.33055653 0.00175209 1.0 Nd Nd1 1 0.33055653 0.66810197 0.49824791 1.0 Nd Nd2 1 0.66810197 0.33055653 0.49824791 1.0 Nd Nd3 1 0.33055653 0.66810197 0.00175209 1.0 Nd Nd4 1 0.73084799 0.00527521 0.75000000 1.0 Nd Nd5 1 0.72930776 0.72930776 0.25000000 1.0 Nd Nd6 1 0.00062846 0.27086715 0.25000000 1.0 Nd Nd7 1 0.00527521 0.73084799 0.75000000 1.0 Nd Nd8 1 0.26687622 0.26687622 0.75000000 1.0 Nd Nd9 1 0.27086715 0.00062846 0.25000000 1.0 Sn Sn10 1 0.99939445 0.61222007 0.25000000 1.0 Sn Sn11 1 0.61222007 0.99939445 0.25000000 1.0 Sn Sn12 1 0.38884713 0.00112936 0.75000000 1.0 Sn Sn13 1 0.00112936 0.38884713 0.75000000 1.0 Sn Sn14 1 0.38781045 0.38781045 0.25000000 1.0 Bi Bi15 1 0.61279926 0.61279926 0.75000000 1.0 Br Br16 1 0.99833824 0.99833824 0.50033776 1.0 Br Br17 1 0.99833824 0.99833824 0.99966224 1.0