4 Lattice=" 25.0 0.0 0.0 0.0 25.0 0.0 0.0 0.0 25.0 " 1 0.7000694 0.661287 1.948722 1 0.7009801 2.943734 0.5112142 1 1.776961 0.8237646 0.2230389 1 2.520436 2.54344 2.202058