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=-0.5980722184628567 stress="0.0382500788261329 -0.00621027578147781 -0.00025556033235955383 -0.00621027578147781 0.05579548629567563 -0.007261408601937288 -0.00025556033235955383 -0.007261408601937288 0.03995345294516486" pbc="F T F"
user09       0.05404852      -0.10166855       0.05252665       0.34773675       0.05935013       0.29342942 
user09       1.52653861       1.40469825       0.06237986      -0.25891098      -0.26691421       0.49964881 
user09       1.54015585       0.19795508       1.28874177      -0.44549417       0.38074337      -0.48428481 
user09       0.08361062       1.27651819       1.62311119       0.35666839      -0.17317929      -0.30879341