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=-5.62015814082501 stress="-0.23330725189277246 -0.002780870570017944 0.047319585815881124 -0.002780870570017944 -0.16436046190658 -0.037351861068770816 0.047319585815881124 -0.037351861068770816 -0.18106523043928502" pbc="F F T"
C       0.16513684       0.24624097       0.17580115      -0.80100367      -2.27982840      -3.49728478 
C       1.35498893       1.61042859       0.20947124       4.32788976       1.15622777      -3.67290559 
C       1.35512851       0.27094606       1.41333883       0.92781391      -1.07406851       2.63786507 
C       0.15488783       1.55988540       1.20245745      -4.45470000       2.19766914       4.53232530