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=7.966976498427371 stress="-1.4009091951307007 -11.096335077154414 0.5112345241328643 -11.096335077154414 -2.1187129967622798 0.06566292934884542 0.5112345241328643 0.06566292934884542 -5.6204220271939915" free_energy=7.966976498427371 pbc="T T F"
C       2.70865944       2.86550211       0.22277084     166.32367442     148.82229974     -41.34315455 
C       1.68584377       1.68362810       0.19581920    -156.64150975    -141.26922380     -80.32299146 
C       1.64685009       0.26959405       1.67626233     -31.13887551      21.75343222     -26.30054466 
C       2.85402479       1.70996341       1.49207130      21.45671084     -29.30650816     147.96669067