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=1.9028622020631363 stress="-10.245880400619054 1.8304438069236433 0.6258457249295724 1.8304438069236433 -11.171732573517282 -2.6550231240468607 0.6258457249295724 -2.6550231240468607 -12.108564163669932" pbc="F F F" Cd -0.07564608 -0.00376694 -0.24160308 -2.25144078 -3.26544338 -4.83838194 Cd 1.72094880 1.71220175 -0.10692155 2.48338594 2.20198423 -2.85736276 Cd 1.67414261 -0.17467664 1.26702863 3.66162963 -3.74672629 2.06100031 Cd 0.08431904 1.40009676 1.42379771 -3.89357479 4.81018544 5.63474440