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=-16.6759172735 stress="2.6957557797625973 -0.6098455108093297 -0.4310528977348608 -0.6098455108093297 0.3327165091747239 -0.9796461663793222 -0.4310528977348608 -0.9796461663793222 0.8140270495518686" pbc="F F F"
C       0.07034430       0.04852473       0.05473499       1.54145186      -2.31765200      -0.88486083 
C       1.41561068       1.63661615      -0.09519967      -4.14556634      -0.71702787       3.27327975 
C       1.37719504      -0.11519386       1.61041876      -4.30127403       3.03797278      -1.86476722 
C      -0.23264389       1.33533445       1.24148635       6.90538850      -0.00329291      -0.52365170