4 Lattice=" 25.0 0.0 0.0 0.0 25.0 0.0 0.0 0.0 25.0 " 1 0.1744302 1.68719 2.464276 1 2.486467 0.7899475 0.5712294999999999 1 1.905651 2.790604 0.4437958 1 2.338845 2.124046 2.568337