6 Lattice=" 25.0 0.0 0.0 0.0 25.0 0.0 0.0 0.0 25.0 " 1 2.693951 4.828533 2.524683 1 0.9874005 3.253704 2.692751 1 1.797506 3.29632 4.784436 1 3.246699 2.730573 2.280252 1 4.077425 2.843272 4.278983 1 4.93943 4.110777 2.41493