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=13.4298640807 stress="-10.105837489349659 4.6037298549627765 0.23722890408805117 4.6037298549627765 -8.68564757264067 0.45518070366226887 0.23722890408805117 0.45518070366226887 -5.432011830345864" pbc="F F F"
O       0.23171545       0.18190327      -0.17816502      -5.16548951      -4.66021160      -6.04063810 
O       1.71219253       1.42485375       0.12990665       6.71325422       6.87291099      -5.66399134 
O       1.28220450       0.28278197       1.56210000      21.43647865     -22.81551869       7.59082046 
O       0.13362859       1.32702941       1.57034430     -22.98424336      20.60281929       4.11380898