6 Lattice=" 25.0 0.0 0.0 0.0 25.0 0.0 0.0 0.0 25.0 " 1 1.939068 2.794248 2.067966 1 1.448231 2.940333 4.223978 1 1.5948 5.060325 2.938211 1 4.644526 2.195179 2.001544 1 4.236112 3.084417 4.332379 1 3.905251 4.388461 2.479334