4 Lattice="1.5 0.0 0.0 0.0 1.5 0.0 0.0 0.0 1.5" Properties=species:S:1:pos:R:3:forces:R:3 energy=1536.786073726196 stress="-1248.9859811259134 -1285.7583274873625 2443.82590640447 -1285.7583274873625 -1711.5491404297827 3764.2204561066733 2443.82590640447 3764.2204561066733 -8735.344389186086" pbc="F T F" user01 -0.16466555 -0.25851365 0.08611608 5449.38798655 8574.71210551 -20073.03853048 user01 0.66459366 0.63735595 -0.21834816 -5.33630021 1.29998102 3.29852037 user01 0.46021073 -0.11223026 0.42561581 694.01571852 183.74406667 308.20008373 user01 -0.29821528 1.04874826 0.52290972 -6138.06740487 -8759.75615319 19761.53992638