5 Lattice=" 25.0 0.0 0.0 0.0 25.0 0.0 0.0 0.0 25.0 " 1 2.079295 2.566064 0.7389026 1 2.731821 0.8253972000000001 1.952601 1 1.402373 2.394344 3.393524 1 2.931703 3.951911 3.265612 1 3.743563 1.858686 3.844421