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=-6.495463585539328 stress="12.407822767688694 -2.7475274244666967 -0.9498334517278639 -2.7475274244666967 11.910225398357701 -0.5052696973115012 -0.9498334517278639 -0.5052696973115012 11.798734405643174" pbc="F F F"
O       0.01344123      -0.25549798      -0.09001716       2.94662769       3.34162330       2.67143901 
O       1.25298470       1.39260881      -0.20954676      -2.88933244      -3.78369700       5.45046315 
O       1.51441454       0.11103756       1.22135239      -6.93056849       5.76906176      -3.10123961 
O       0.24276846       1.20665188       1.32022929       6.87327325      -5.32698807      -5.02066255