5 Lattice=" 25.0 0.0 0.0 0.0 25.0 0.0 0.0 0.0 25.0 " 1 2.285903 1.887977 1.671083 1 2.68762 1.716714 3.675724 1 2.821512 3.759774 2.999624 1 4.480266 2.258259 2.346621 1 5.253697 4.060686 3.32016