4
Lattice="1.5 0.0 0.0 0.0 1.5 0.0 0.0 0.0 1.5" Properties=species:S:1:pos:R:3:forces:R:3 energy=770.9194433759621 stress="-705.1688976032012 -25.04599915048131 48.064979890355 -25.04599915048131 -917.3194151816328 232.64416637820574 48.064979890355 232.64416637820574 -730.2689020102562" pbc="F T F"
user01       0.08004885       0.13417175       0.33595892   -3021.36959195   -1071.72429284   -1794.12252975 
user01       0.63813862       0.46439497       0.41657831    3269.87444871    4420.37648554   -3564.25499141 
user01       0.56425730      -0.01155935       0.78277713    1702.82099116   -5547.29584878    3140.59079668 
user01       0.21813893       0.51716069       0.94410236   -1951.32584792    2198.64365608    2217.78672449