# generated using pymatgen data_Nd3TiSb5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.52639865 _cell_length_b 9.52684379 _cell_length_c 6.18524185 _cell_angle_alpha 89.99914886 _cell_angle_beta 90.00028097 _cell_angle_gamma 119.99581169 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nd3TiSb5 _chemical_formula_sum 'Nd6 Ti2 Sb10' _cell_volume 486.16472055 _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 0.61989560 -0.00000441 0.74999842 1.0 Nd Nd1 1 0.38014479 -0.00000322 0.25000257 1.0 Nd Nd2 1 0.00001281 0.61986702 0.75000104 1.0 Nd Nd3 1 0.00001324 0.38011477 0.25000288 1.0 Nd Nd4 1 0.38013715 0.38012054 0.74999820 1.0 Nd Nd5 1 0.61989196 0.61987435 0.25000238 1.0 Ti Ti6 1 0.00001710 -0.00000430 0.50000080 1.0 Ti Ti7 1 0.00001708 -0.00000528 0.00000114 1.0 Sb Sb8 1 0.25201337 -0.00000115 0.75000626 1.0 Sb Sb9 1 0.74800269 -0.00000128 0.24999345 1.0 Sb Sb10 1 0.00000408 0.25200156 0.75000527 1.0 Sb Sb11 1 0.00001248 0.74799422 0.25000364 1.0 Sb Sb12 1 0.74800022 0.74799284 0.75000621 1.0 Sb Sb13 1 0.25201097 0.25200442 0.24999261 1.0 Sb Sb14 1 0.33330152 0.66669028 0.49998604 1.0 Sb Sb15 1 0.66661421 0.33334304 0.50000076 1.0 Sb Sb16 1 0.66661418 0.33334345 -0.00000029 1.0 Sb Sb17 1 0.33329655 0.66667213 -0.00000038 1.0