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=30.16300358598895 stress="-3.522258023714512 0.1953635939132798 0.14226114890183406 0.1953635939132798 -3.2718768929045834 -0.1362549402268127 0.14226114890183406 -0.1362549402268127 -2.33704662945786" pbc="T T F" Cd -0.24794580 0.15488783 0.05988540 6.24202130 12.73500877 -23.16677746 Cd 1.20245745 1.66431082 0.03277713 -4.82632535 -12.12339246 -24.33499723 Cd 1.39971974 -0.12633864 1.46097674 -11.67472803 21.09540732 26.27677464 Cd -0.21780693 1.71813893 1.26716069 10.25903209 -21.70702363 21.22500005