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=31843.271762093806 stress="-122697.15431084926 54242.84766847832 21829.56529141267 54242.84766847832 -156394.1263115924 37841.05261448014 21829.56529141267 37841.05261448014 -108524.00270937156" pbc="F F F"
Pr      -0.08329169       0.08172953       0.04191768  -12251.26042395  -14567.85877738  -20774.43427375 
Pr       1.64409328       1.74073298       0.20906961   12318.33824829   65306.69214882  -58082.05291528 
Pr       1.72570548       0.22557135       1.35056984   67343.91449280 -100707.04922188   36267.74956688 
Pr       0.21942316       1.33324477       1.70364012  -67410.99231714   49968.21585043   42588.73762215