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=217.56923816718523 stress="-8.27511069907926 0.31629360194782286 -1.0808675158791774 0.31629360194782286 -21.83570614514718 -0.697928270631422 -1.0808675158791774 -0.697928270631422 -21.576434884863392" pbc="F T T" Cd 0.01129231 -0.11930528 0.29849013 -86.71738285 1.57067211 -9.27222051 Te 1.30454100 1.62365747 0.04708384 78.00970850 -16.10716408 1.16156997 Te 1.45297513 -0.15318125 1.36894099 86.95755519 8.37090748 19.48529138 Cd 0.04737131 1.32879661 1.74404962 -78.24988084 6.16558450 -11.37464084