4 Lattice=" 25.0 0.0 0.0 0.0 25.0 0.0 0.0 0.0 25.0 " 1 1.368967 3.862197 2.346954 1 2.915655 3.525719 0.4290147 1 3.711297 1.607736 1.156277 1 3.762397 3.78477 2.460668