4 Lattice=" 25.0 0.0 0.0 0.0 25.0 0.0 0.0 0.0 25.0 " 1 2.467571 3.281377 3.110997 1 5.173864 0.7299006 2.779254 1 3.33415 1.630232 1.910302 1 4.266226 2.432899 3.50232