6 Lattice=" 25.0 0.0 0.0 0.0 25.0 0.0 0.0 0.0 25.0 " 1 1.617948 3.024291 1.012928 1 1.30973 1.622672 3.703727 1 2.879916 3.04735 3.836046 1 0.9226834 3.798669 3.025472 1 3.183378 1.61886 2.358361 1 3.567629 4.016165 2.010815