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=-11.3399160198 stress="-4.757645924805916 -0.07299504542704952 -1.029377953173321 -0.07299504542704952 -3.520323692669303 -0.7191689863760631 -1.029377953173321 -0.7191689863760631 -5.0330844371036925" pbc="F F F"
C       0.04852473       0.05473499      -0.08438932      -8.75862838      -6.28880181     -10.93095380 
C       1.63661615       1.40480033      -0.12280496       4.27637865       5.43476967      -3.12985887 
C       1.29869006       0.11041876       1.26735611       9.53878304      -5.56607114       8.37177979 
C      -0.16466555       1.24148635       1.58611608      -5.05653331       6.42010327       5.68903288