6 Lattice=" 25.0 0.0 0.0 0.0 25.0 0.0 0.0 0.0 25.0 " 1 2.266958 0.2808875 2.923165 1 1.972839 2.886908 2.420784 1 0.6227844 1.897999 3.691493 1 3.0949 1.65874 4.813271 1 4.223624 2.255199 3.062463 1 4.675559 3.55825 4.934237