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:Z:I:1:forces:R:3 energy=102.55512731141366 pbc="T T F" C -0.12320595 -0.04105180 0.20259391 6 -135.51066916 -95.32030733 -76.70808304 C 0.81504129 0.45865944 -0.13449789 6 93.20354034 30.74845719 -111.18647355 C 0.53802619 0.22277084 0.93584377 6 153.87359149 -202.01579191 142.83905338 C 0.18362810 0.94581920 0.89685009 6 -111.56646267 266.58764205 45.05550321