5 Lattice=" 25.0 0.0 0.0 0.0 25.0 0.0 0.0 0.0 25.0 " 1 0.5231689 0.1640524 1.493785 1 2.625554 0.07182531 0.04730882 1 2.391634 1.372958 2.83206 1 1.806242 1.946446 0.9821647 1 1.54049 2.8226 2.60214