4
Lattice=" 25.0 0.0 0.0 0.0 25.0 0.0 0.0 0.0 25.0 "
1 2.007849 1.586086 2.268554
1 2.12772 3.766083 1.838374
1 4.424479 1.287894 2.441313
1 3.363204 2.429439 0.4572432