4
Lattice="1.5 0.0 0.0 0.0 1.5 0.0 0.0 0.0 1.5" Properties=species:S:1:pos:R:3:forces:R:3 energy=803.423487099 stress="-1073.9523118738948 86.73708376294815 37.127031844407334 86.73708376294815 -1086.6827404950723 25.535845936192466 37.127031844407334 25.535845936192466 -471.6468971682162" pbc="T T F"
C       0.02188662       0.08947759       0.14570436      73.52493332     -61.35086582    -567.79214117 
C       0.80727680       0.76626791       0.07452345      19.33460755     117.64263169    -571.89748595 
C       0.62829384       0.05304647       0.73301999     -46.35857193    -149.47273094     538.67178085 
C      -0.09700988       0.66078799       0.75680799     -46.50096895      93.18096506     601.01784626