4 Lattice=" 25.0 0.0 0.0 0.0 25.0 0.0 0.0 0.0 25.0 " 1 2.534514 2.228148 2.279478 1 2.568469 4.258609 2.123082 1 4.573888 5.069598 2.661577 1 4.270042 3.378559 1.121613