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=149.88905009394853 stress="-14.15503002322624 -0.1724060509334834 0.16787100299018984 -0.1724060509334834 -7.607953761843611 -0.2534029071526176 0.16787100299018984 -0.2534029071526176 -15.8257000062642" pbc="T F T" Cd -0.11174318 0.19178619 0.17895518 25.79888472 -76.65374002 -24.59738943 Cd 1.79140871 1.61455359 0.09583508 -31.17432148 79.25367631 -10.29394720 Cd 1.64904689 0.10609294 1.46603997 -35.32394681 -78.64575856 14.75306883 Cd -0.19401975 1.32157598 1.51361598 40.69938357 76.04582226 20.13826779