# generated using pymatgen data_Nd5Sn3Cl _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.43179431 _cell_length_b 9.43179389 _cell_length_c 6.78625722 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999799 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nd5Sn3Cl _chemical_formula_sum 'Nd10 Sn6 Cl2' _cell_volume 522.81685414 _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 0.26093063 1.00000000 0.25000000 1.0 Nd Nd1 1 0.73906937 0.00000000 0.75000000 1.0 Nd Nd2 1 0.00000000 0.26093063 0.25000000 1.0 Nd Nd3 1 0.00000000 0.73906937 0.75000000 1.0 Nd Nd4 1 0.73906937 0.73906937 0.25000000 1.0 Nd Nd5 1 0.26093063 0.26093063 0.75000000 1.0 Nd Nd6 1 0.33333300 0.66666700 0.00000000 1.0 Nd Nd7 1 0.66666700 0.33333300 0.00000000 1.0 Nd Nd8 1 0.66666700 0.33333300 0.50000000 1.0 Nd Nd9 1 0.33333300 0.66666700 0.50000000 1.0 Sn Sn10 1 0.61205646 1.00000000 0.25000000 1.0 Sn Sn11 1 0.38794354 0.00000000 0.75000000 1.0 Sn Sn12 1 0.00000000 0.61205646 0.25000000 1.0 Sn Sn13 1 0.00000000 0.38794354 0.75000000 1.0 Sn Sn14 1 0.38794354 0.38794354 0.25000000 1.0 Sn Sn15 1 0.61205646 0.61205646 0.75000000 1.0 Cl Cl16 1 0.00000000 0.00000000 0.00000000 1.0 Cl Cl17 1 0.00000000 0.00000000 0.50000000 1.0