# generated using pymatgen data_Th3Al3IrPd2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.27336277 _cell_length_b 7.27336256 _cell_length_c 4.16056406 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000093 _symmetry_Int_Tables_number 1 _chemical_formula_structural Th3Al3IrPd2 _chemical_formula_sum 'Th3 Al3 Ir1 Pd2' _cell_volume 190.61335528 _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 Th Th0 1 0.42709136 0.00543859 0.50000000 1.0 Th Th1 1 0.99456141 0.42165277 0.50000000 1.0 Th Th2 1 0.57834723 0.57290864 0.50000000 1.0 Al Al3 1 0.77157865 0.00396252 0.00000000 1.0 Al Al4 1 0.99603748 0.76761713 0.00000000 1.0 Al Al5 1 0.23238287 0.22842135 0.00000000 1.0 Ir Ir6 1 0.66666700 0.33333300 0.00000000 1.0 Pd Pd7 1 0.33333300 0.66666700 0.00000000 1.0 Pd Pd8 1 0.00000000 0.00000000 0.50000000 1.0