4 Lattice=" 25.0 0.0 0.0 0.0 25.0 0.0 0.0 0.0 25.0 " 1 0.03824735 0.17931 2.217788 1 0.3920207 2.402909 0.5996192 1 1.210981 1.908369 2.946369 1 2.769481 2.512876 1.592808