6 Lattice=" 25.0 0.0 0.0 0.0 25.0 0.0 0.0 0.0 25.0 " 1 2.924097 1.394529 2.047948 1 0.8517503 3.0229 2.150903 1 3.084941 2.892354 0.5199401 1 2.119748 2.11188 4.047438 1 4.365389 1.647318 4.564937 1 3.247696 3.944508 2.731386