4 Lattice=" 25.0 0.0 0.0 0.0 25.0 0.0 0.0 0.0 25.0 " 1 1.535194 1.575745 0.9575201 1 2.876418 2.846256 2.072388 1 1.405579 4.031525 1.011343 1 3.667512 4.896193 0.8880135