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=0.2971346981192533 stress="-0.4052326742334617 -0.08918426669074793 0.08610132793563947 -0.08918426669074793 -0.2638314645634989 -0.05294007997504999 0.08610132793563947 -0.05294007997504999 -0.390994985324017" pbc="T F T"
O      -0.08147842       0.19178619       0.17895518       1.64293291      -2.38231654      -2.26406864 
O       1.64339576       1.61455359       0.03253581      -0.29447738       1.18959168      -0.29818736 
O       1.64904689       0.10609294       1.46603997      -3.57916908      -3.35949476       0.85659547 
O      -0.19401975       1.32157598       1.51361598       2.23071355       4.55221962       1.70566054