4 Lattice=" 25.0 0.0 0.0 0.0 25.0 0.0 0.0 0.0 25.0 " 1 0.9651302 0.0332184 0.09604495 1 1.129779 0.3019077 2.825054 1 2.558191 0.7044327 0.6108776 1 2.484706 2.424759 2.944886