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=-5.245330123974531 stress="0.006694898001007372 -0.027642206905238668 -0.09368729769599556 -0.027642206905238668 -0.280155985317754 -0.03158588842980317 -0.09368729769599556 -0.03158588842980317 -0.27715681179726903" free_energy=-5.245330123974531 pbc="T F T"
C       2.77050863       0.19178619       0.17895518      -0.21505058      -3.20285288      -1.84711355 
C       1.79140871       1.61455359       0.03253581       0.83748545       2.11862889      -2.75227779 
C       1.71234616       0.10609294       1.46603997      -0.21227215      -2.73549752       0.35185617 
C       2.80598025       1.32157598       1.51361598      -0.41016272       3.81972151       4.24753517