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=-4.42508611117 stress="4.926975289617575 -0.03337561418155263 1.4862180282763802 -0.03337561418155263 -1.2045529352311353 0.515859208573853 1.4862180282763802 0.515859208573853 3.166744021104695" pbc="F F F" C -0.16466555 -0.20015830 0.08611608 9.75165347 -0.93435360 7.35591066 C 1.28014816 1.50792367 -0.07600147 -4.08209906 2.43920225 4.11602012 C 1.46375436 -0.09416457 1.25559716 -9.78003337 -2.13315951 -7.19181114 C -0.01634289 1.78328166 1.15084337 4.11047897 0.62831086 -4.28011964