# generated using pymatgen data_NdTh3(HgPd2)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.86448344 _cell_length_b 7.86448316 _cell_length_c 3.83824991 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 88.79761553 _symmetry_Int_Tables_number 1 _chemical_formula_structural NdTh3(HgPd2)2 _chemical_formula_sum 'Nd1 Th3 Hg2 Pd4' _cell_volume 237.34385924 _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 0.67659110 0.17659110 0.50000000 1.0 Th Th1 1 0.32560060 0.82560060 0.50000000 1.0 Th Th2 1 0.82441226 0.67448998 0.50000000 1.0 Th Th3 1 0.17448998 0.32441226 0.50000000 1.0 Hg Hg4 1 0.99507783 0.00127645 0.00000000 1.0 Hg Hg5 1 0.50127645 0.49507783 0.00000000 1.0 Pd Pd6 1 0.36742827 0.12301428 0.00000000 1.0 Pd Pd7 1 0.88180851 0.38180851 0.00000000 1.0 Pd Pd8 1 0.13030072 0.63030072 0.00000000 1.0 Pd Pd9 1 0.62301428 0.86742827 0.00000000 1.0