4 Lattice=" 25.0 0.0 0.0 0.0 25.0 0.0 0.0 0.0 25.0 " 1 2.556971 2.552645 1.444238 1 1.346745 4.036168 2.632189 1 4.72284 2.761792 1.695012 1 3.352579 4.496526 1.366389