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=-12.603656025685057 stress="0.7813693766575336 0.29799584936506357 0.1039850370378243 0.29799584936506357 0.7883713716914625 -0.04134564354625651 0.1039850370378243 -0.04134564354625651 0.3294574339379313" free_energy=-12.603656025685057 pbc="T F F"
C        0.10609294       0.01361598       0.06329927       0.26171352       7.83653184       1.19196203
C        1.64034165       1.27846858       0.09073906       1.81534733      -8.20107126       4.26163272
C        1.77219963       0.13132919       1.75978669       6.67510974       9.86061440      -2.30547354
C       -0.27407488       1.28504734       1.68365717      -8.75217060      -9.49607498      -3.14812121