6 Lattice=" 25.0 0.0 0.0 0.0 25.0 0.0 0.0 0.0 25.0 " 1 1.127389 1.171603 0.6946463 1 1.009133 1.283908 2.574652 1 0.7652821 2.93985 0.2651139 1 0.0212665 2.421916 2.924129 1 2.909562 0.955426 0.4927479 1 2.967895 0.4293313 2.317144