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=8693.391012364931 stress="-1441.0668113865586 471.12692484811555 -435.32673020641806 471.12692484811555 -1212.8563686580512 -221.2929394525056 -435.32673020641806 -221.2929394525056 -1236.1646789630552" pbc="T T T" Xe -0.14459490 0.11115480 -0.01275680 14441.19662569 -15741.28403235 -978.55598038 Xe 1.70960170 1.31143450 0.04092907 -24729.11579606 14800.66196492 -9547.98902544 Xe 1.35333724 0.05786860 1.64041416 -1504.40273595 -2943.11356548 -2654.05466081 Xe -0.22187219 1.51878885 1.32834452 11792.32190632 3883.73563291 13180.59966664