5 Lattice=" 25.0 0.0 0.0 0.0 25.0 0.0 0.0 0.0 25.0 " 1 2.952679 1.285696 1.277172 1 2.70476 3.581398 0.6839532 1 5.281402 1.844449 2.934305 1 3.202591 1.662081 4.066135 1 3.851193 3.569192 2.69225