32 Lattice="51.502774238586426 0.0 0.0 0.0 51.502774238586426 0.0 0.0 0.0 51.502774238586426" Properties=species:S:1:pos:R:3:forces:R:3 energy=2.138703311078765 stress="-8.947273484694756e-05 -1.1202369444178734e-05 -7.75125585665022e-06 -1.1202369444178734e-05 -0.00010681375676928788 -1.7409665860118513e-05 -7.75125585665022e-06 -1.7409665860118513e-05 -0.00010008692385322086" free_energy=2.138703311078765 pbc="F F F" O 25.55299055 25.72214520 25.55355692 -0.21235481 -0.20017872 -0.24606487 O 27.69296441 27.62852592 25.71143717 -0.13811687 0.13247146 -0.56574719 O 27.69571600 25.61805969 27.50661517 0.71270125 -0.60454217 -0.76847973 O 25.68315916 27.34178869 27.78421248 -0.48101250 -0.35708677 0.29382944 O 29.22427925 25.55195143 25.90031607 -0.41618397 -0.40363677 0.34256382 O 31.42874791 27.56453016 25.71208398 0.31226641 -0.05671521 -0.41451711 O 31.08915121 25.50199511 27.38097366 0.28409075 -0.44371898 -0.10688200 O 29.30206016 27.41628651 27.79359922 -0.36757145 -0.09687481 0.56214285 O 25.51102323 29.51012498 25.87716982 -0.42622584 -0.10839808 -0.37177278 O 27.71413787 31.07301195 25.87244491 0.44520383 0.15961994 -0.26261492 O 27.62248891 29.56474104 27.81243452 -0.36260874 0.06945958 0.05745735 O 25.90070480 31.31918982 27.72571030 -0.39136500 0.28215333 0.18974084 O 29.42606700 29.45598449 25.91010212 -0.23899435 0.18498469 -0.49515514 O 31.32926413 31.20778119 25.51158105 0.27911130 0.28647763 -0.29516713 O 31.41437182 29.35024886 27.55528988 0.51064468 -0.44625001 0.47953688 O 29.32392506 31.29721607 27.54124862 0.14975436 0.44491665 0.00101354 O 25.91839267 25.79844386 29.45934110 -0.47326314 -0.04349295 -0.40333532 O 27.73227856 27.43080394 29.44835912 0.56593049 -0.27099479 -0.45911801 O 27.52277279 25.86264212 31.39136565 -0.28033743 -0.21068996 0.50911485 O 25.94683766 27.61977479 31.29712741 -0.20979079 -0.08552006 0.51192724 O 29.23440042 25.62198734 29.39740704 -0.13742363 -0.28835690 -0.13818714 O 31.26894392 27.79041169 29.20146815 0.38728530 0.41195103 -0.53362826 O 31.19435775 25.87146093 31.24902088 -0.26690516 0.31385722 0.30908540 O 29.60434793 27.42068865 31.40508657 0.74186853 -0.52937132 0.60319882 O 25.71701036 29.46392958 29.20863243 -0.33368116 0.23001276 -0.33641697 O 27.75978975 31.42094823 29.73300721 0.25788888 0.50973905 0.45133153 O 27.62276944 29.39162385 31.03904406 0.28212354 -0.01251746 0.19620412 O 25.85098361 31.24271964 31.38157114 -0.33595735 0.27023011 0.31491860 O 29.48613819 29.36392377 29.61744904 -0.12328987 -0.05910235 0.26886070 O 31.08560816 31.49907600 28.99107122 0.03135686 0.42275004 -0.25983242 O 31.50411578 29.63804418 31.24341234 0.48275751 0.02136945 0.36716827 O 29.49912454 31.27568132 31.27375468 -0.24790163 0.47745436 0.19882474