# generated using pymatgen data_Nd4ThPd15 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.18551874 _cell_length_b 4.18551874 _cell_length_c 20.78953799 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nd4ThPd15 _chemical_formula_sum 'Nd4 Th1 Pd15' _cell_volume 364.20291646 _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 0.00000000 0.00000000 0.20133659 1.0 Nd Nd1 1 0.00000000 0.00000000 0.39995291 1.0 Nd Nd2 1 0.00000000 0.00000000 0.60004709 1.0 Nd Nd3 1 0.00000000 0.00000000 0.79866341 1.0 Th Th4 1 0.00000000 0.00000000 0.00000000 1.0 Pd Pd5 1 0.50000000 0.50000000 0.00000000 1.0 Pd Pd6 1 0.50000000 0.50000000 0.19956465 1.0 Pd Pd7 1 0.50000000 0.50000000 0.40007651 1.0 Pd Pd8 1 0.50000000 0.50000000 0.59992349 1.0 Pd Pd9 1 0.50000000 0.50000000 0.80043535 1.0 Pd Pd10 1 0.50000000 0.00000000 0.09850618 1.0 Pd Pd11 1 0.50000000 0.00000000 0.29990481 1.0 Pd Pd12 1 0.50000000 0.00000000 0.50000000 1.0 Pd Pd13 1 0.50000000 0.00000000 0.70009519 1.0 Pd Pd14 1 0.50000000 0.00000000 0.90149382 1.0 Pd Pd15 1 0.00000000 0.50000000 0.09850618 1.0 Pd Pd16 1 0.00000000 0.50000000 0.29990481 1.0 Pd Pd17 1 0.00000000 0.50000000 0.50000000 1.0 Pd Pd18 1 0.00000000 0.50000000 0.70009519 1.0 Pd Pd19 1 0.00000000 0.50000000 0.90149382 1.0