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=209.57659859729443 stress="-12.32331857342784 -0.4583825609274252 -0.10443579234047455 -0.4583825609274252 -6.525303686249087 -0.38731935485820096 -0.10443579234047455 -0.38731935485820096 -13.176376104510238" free_energy=209.57659859729443 pbc="T F T"
C       0.03848316       0.19178619       0.17895518      25.43216294     -62.13733361     -30.87023850 
C       1.79140871       1.61455359       0.09583508     -38.26829128      58.83438084     -17.61276827 
C       1.64904689       0.10609294       1.46603997     -43.04550457     -73.01124592      15.84482019 
C       2.80598025       1.32157598       1.51361598      55.88163291      76.31419870      32.63818658