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=-5.502248346281284 stress="0.045921012228979916 0.1315904944146988 0.04771172456155655 0.1315904944146988 -0.5327930651687229 0.05306595418261708 0.04771172456155655 0.05306595418261708 -0.19150671945696668" free_energy=-5.502248346281284 pbc="F T F"
C       0.36909256       0.04852473       0.05473499       0.93565803       3.04424610      -1.41205826 
C       1.41561068       1.40952586       0.11041876       0.21052696      -1.86018967      -2.82527516 
C       1.26735611       2.83533445       1.24148635      -1.51072691      -1.64342682       2.42757664 
C       0.08611608       1.53369179       1.40689122       0.36454192       0.45937039       1.80975678