4 Lattice=" 25.0 0.0 0.0 0.0 25.0 0.0 0.0 0.0 25.0 " 1 5.517305 2.823831 2.520754 1 3.206819 2.056835 2.580452 1 4.931014 5.152147 1.608787 1 3.498861 3.411494 1.086096