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=14283.822574103884 stress="-2256.9671281252104 511.7710147693921 699.7309495892138 511.7710147693921 -2232.645674824195 175.65689453360554 699.7309495892138 175.65689453360554 -2341.5544711174257" pbc="F T T" Sg 0.17488898 -0.04333925 0.42784709 -26495.29344718 26517.46418664 -14408.80392049 Sg 1.32343844 1.74271422 0.25119846 39465.87476164 -19088.99850462 -33662.24391087 Sg 1.63080748 0.04693862 1.48888263 12241.82290226 6402.20505622 11365.68630976 Sg 0.26268279 1.58371483 1.48894650 -25212.40421672 -13830.67073824 36705.36152160