4 Lattice=" 25.0 0.0 0.0 0.0 25.0 0.0 0.0 0.0 25.0 " 1 1.945352 2.412058 0.9382196 1 2.796213 2.491472 3.200201 1 0.8595983 4.85908 2.462047 1 3.121335 4.067774 1.150086