4 Lattice=" 25.0 0.0 0.0 0.0 25.0 0.0 0.0 0.0 25.0 " 1 1.382185 0.3943114 1.075216 1 0.9807846 1.486461 2.753824 1 0.491957 1.894504 0.6685531 1 1.794418 2.681383 2.23804