# generated using pymatgen data_Nd4Dy3ThSe12 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.13788199 _cell_length_b 11.01834813 _cell_length_c 11.31479359 _cell_angle_alpha 90.28686598 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nd4Dy3ThSe12 _chemical_formula_sum 'Nd4 Dy3 Th1 Se12' _cell_volume 515.86466717 _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 0.75000000 0.50481772 0.69680383 1.0 Nd Nd1 1 0.75000000 0.99742400 0.19476395 1.0 Nd Nd2 1 0.25000000 0.50619842 0.30169074 1.0 Nd Nd3 1 0.25000000 0.99398003 0.80910952 1.0 Dy Dy4 1 0.25000000 0.31170432 0.98925841 1.0 Dy Dy5 1 0.75000000 0.81124326 0.51120847 1.0 Dy Dy6 1 0.75000000 0.68677241 0.01096079 1.0 Th Th7 1 0.25000000 0.18901100 0.48826179 1.0 Se Se8 1 0.25000000 0.30064306 0.72854416 1.0 Se Se9 1 0.25000000 0.20036142 0.22747955 1.0 Se Se10 1 0.75000000 0.70487530 0.26915840 1.0 Se Se11 1 0.75000000 0.79408949 0.77004548 1.0 Se Se12 1 0.75000000 0.05213009 0.62079630 1.0 Se Se13 1 0.75000000 0.44511988 0.11381112 1.0 Se Se14 1 0.25000000 0.94222455 0.38539669 1.0 Se Se15 1 0.25000000 0.55296622 0.88713866 1.0 Se Se16 1 0.25000000 0.63244135 0.54250352 1.0 Se Se17 1 0.25000000 0.86668398 0.04365461 1.0 Se Se18 1 0.75000000 0.37652771 0.45276734 1.0 Se Se19 1 0.75000000 0.13078778 0.95664668 1.0