5 Lattice=" 25.0 0.0 0.0 0.0 25.0 0.0 0.0 0.0 25.0 " 1 2.114 2.095272 1.915779 1 2.14246 0.9228837 3.956719 1 3.791491 3.03012 0.940196 1 4.524648 0.3016751 5.057567 1 3.666195 2.4276 3.537085