# generated using pymatgen data_Nd3Y2Sn3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.16404043 _cell_length_b 9.16404195 _cell_length_c 6.72943601 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000168 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nd3Y2Sn3 _chemical_formula_sum 'Nd6 Y4 Sn6' _cell_volume 489.42185323 _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 0.24154469 0.00000000 0.25000000 1.0 Nd Nd1 1 0.24154469 0.24154469 0.75000000 1.0 Nd Nd2 1 0.00000000 0.75845531 0.75000000 1.0 Nd Nd3 1 0.00000000 0.24154469 0.25000000 1.0 Nd Nd4 1 0.75845531 0.75845531 0.25000000 1.0 Nd Nd5 1 0.75845531 0.00000000 0.75000000 1.0 Y Y6 1 0.33333300 0.66666700 0.00000000 1.0 Y Y7 1 0.66666700 0.33333300 0.50000000 1.0 Y Y8 1 0.66666700 0.33333300 0.00000000 1.0 Y Y9 1 0.33333300 0.66666700 0.50000000 1.0 Sn Sn10 1 0.60250741 0.00000000 0.25000000 1.0 Sn Sn11 1 0.60250741 0.60250741 0.75000000 1.0 Sn Sn12 1 0.00000000 0.39749259 0.75000000 1.0 Sn Sn13 1 1.00000000 0.60250741 0.25000000 1.0 Sn Sn14 1 0.39749259 0.39749259 0.25000000 1.0 Sn Sn15 1 0.39749259 1.00000000 0.75000000 1.0