# generated using pymatgen data_Nd5Bi3Cl _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.56063761 _cell_length_b 9.56063654 _cell_length_c 6.65548057 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99829748 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nd5Bi3Cl _chemical_formula_sum 'Nd10 Bi6 Cl2' _cell_volume 526.85507395 _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 0.66667501 0.33332728 0.00000085 1.0 Nd Nd1 1 0.33332828 0.66667601 0.00000085 1.0 Nd Nd2 1 0.26694667 0.99999074 0.24999881 1.0 Nd Nd3 1 0.99999074 0.26694667 0.24999881 1.0 Nd Nd4 1 0.73306688 0.73306688 0.25000117 1.0 Nd Nd5 1 0.66667272 0.33332499 0.49999985 1.0 Nd Nd6 1 0.33332499 0.66667272 0.49999985 1.0 Nd Nd7 1 0.73305333 0.00000926 0.74999981 1.0 Nd Nd8 1 0.26693312 0.26693312 0.75000217 1.0 Nd Nd9 1 0.00000926 0.73305433 0.74999981 1.0 Bi Bi10 1 0.61451600 0.00000411 0.25000015 1.0 Bi Bi11 1 0.00000411 0.61451600 0.25000015 1.0 Bi Bi12 1 0.38547707 0.38547707 0.25000100 1.0 Bi Bi13 1 0.38548400 0.99999589 0.74999915 1.0 Bi Bi14 1 0.99999689 0.38548400 0.74999915 1.0 Bi Bi15 1 0.61452293 0.61452293 0.75000100 1.0 Cl Cl16 1 0.00000047 0.00000047 0.00000021 1.0 Cl Cl17 1 0.99999953 0.99999953 0.49999921 1.0