3 Lattice=" 25.0 0.0 0.0 0.0 25.0 0.0 0.0 0.0 25.0 " 1 2.121124 0.8895767999999999 2.441287 1 1.730932 3.237888 2.870814 1 3.876861 2.359196 2.796097