5 Lattice=" 25.0 0.0 0.0 0.0 25.0 0.0 0.0 0.0 25.0 " 1 0.9320143 3.012582 2.150962 1 2.172573 2.316103 4.293659 1 2.198257 4.51425 3.345177 1 3.106694 2.5483 1.973249 1 3.92193 5.175884 1.747773