4 Lattice=" 25.0 0.0 0.0 0.0 25.0 0.0 0.0 0.0 25.0 " 1 0.438828 2.90963 1.106787 1 1.47463 4.835343 1.863436 1 2.314132 3.251036 2.795551 1 3.696872 4.248886 0.9164855