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=34.6793889644 stress="-12.23006626668078 3.129130570949843 -0.7599161168202829 3.129130570949843 -13.768537253538032 0.3859143315419068 -0.7599161168202829 0.3859143315419068 -10.96388483143493" pbc="F F F"
O      -0.12320595      -0.04105180       0.20259391     -22.36492960     -15.64291195     -14.53790550 
O       1.56504129       1.20865944      -0.13449789      16.55915026      13.05628662     -20.54523699 
O       1.28802619       0.22277084       1.68584377      32.24451431     -35.81642165      25.33610685 
O       0.18362810       1.69581920       1.64685009     -26.43873498      38.40304698       9.74703564