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:Z:I:1:forces:R:3 energy=-7.597342128949868 pbc="F F T" C -0.15527974 -0.03929960 0.03981035 6 -2.36534310 -2.06967994 0.06236889 C 1.73956773 1.22557373 -0.09022051 6 2.16407694 1.68580622 -0.56016181 C 1.64408857 -0.02462475 1.70902946 6 1.86539782 -1.75481140 0.32757487 C -0.20409991 1.66265408 1.19291875 6 -1.66413166 2.13868513 0.17021804