5 Lattice=" 25.0 0.0 0.0 0.0 25.0 0.0 0.0 0.0 25.0 " 1 2.611679 2.016684 2.717461 1 4.323341 0.727724 2.330974 1 4.46399 3.048062 1.959515 1 3.51112 1.5374 4.631239 1 3.533059 3.74018 3.907793