4 Lattice=" 25.0 0.0 0.0 0.0 25.0 0.0 0.0 0.0 25.0 " 1 0.8418466999999999 2.762205 0.4902926 1 2.44915 0.8560816 2.901808 1 2.702124 1.919715 0.4432873 1 2.179656 2.770411 2.292824