4 Lattice="3.0 0.0 0.0 0.0 3.0 0.0 0.0 0.0 3.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=51.38028486598539 stress="-106.81821550623172 23.885872502510487 4.591676477031584 23.885872502510487 -88.78891580197441 2.0873417839003707 4.591676477031584 2.0873417839003707 -90.82251446350256" pbc="F F F" Cd 0.23171545 0.18190327 -0.17816502 -23.58613979 -22.05856404 -31.09301214 Cd 1.71219253 1.42485375 0.12990665 31.52243525 28.55829995 -25.50195796 Cd 1.28220450 0.28278197 1.56210000 51.69142564 -58.16186714 33.70661916 Cd 0.13362859 1.32702941 1.57034430 -59.62772111 51.66213122 22.88835094