32 Lattice="42.0 0.0 0.0 0.0 42.0 0.0 0.0 0.0 42.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=1324.8652225512274 stress="-0.039453896971257736 -0.0009127155980397366 0.0007616081418083267 -0.0009127155980397366 -0.03861752868445363 -0.00019181437330312057 0.0007616081418083267 -0.00019181437330312057 -0.03659664999919436" free_energy=1324.8652225512274 pbc="F F F" Hg 20.85498893 21.11042859 21.20947124 -64.68534067 -89.95736383 -82.91634624 Hg 22.25429999 22.55280714 20.91333883 24.93199003 -62.30982554 -121.83898807 Hg 22.60890829 20.87241235 22.17068940 -33.76913478 -107.20057404 55.38518910 Hg 20.91049160 22.22286420 22.43858073 -91.81943463 17.75024652 50.12341261 Hg 23.75205420 21.15488783 21.05988540 70.32636618 -69.89603155 -106.36183641 Hg 25.20245745 22.66431082 20.81425730 68.01996279 -28.77086079 -76.61500326 Hg 25.48844065 21.03277713 22.60977329 58.03916378 -63.98204269 -40.68550821 Hg 23.87366136 22.67309405 22.28219307 26.92097913 -14.55826748 14.42321479 Hg 21.21813893 23.76716069 21.19410236 -168.86350672 75.98300253 -102.47646999 Hg 22.28065187 25.38201197 20.93300593 -26.04572346 77.73529125 -50.69750078 Hg 22.22002482 23.77696427 22.41661558 27.90119571 54.02799677 84.68187913 Hg 20.96512192 25.72586561 23.08985867 -80.87359849 45.86639786 -55.54215871 Hg 23.72614529 24.02103145 20.77761356 21.14699830 32.67912126 -91.97090849 Hg 25.68220204 25.39362841 21.23573857 45.35405122 62.97242752 -52.13745135 Hg 25.52724172 23.93248609 22.20296332 74.82151628 -9.68679864 37.67728341 Hg 23.83930155 25.72083292 22.14672164 3.07847533 75.34927589 2.12984143 Hg 20.98735431 20.92299150 23.90698366 -44.13112494 -62.00492072 23.99533766 Hg 22.68107110 22.32825321 24.13102478 -53.48876698 22.50700840 -34.77772235 Hg 22.57659662 21.26120756 25.51193751 -31.78082991 -90.07534882 97.81099508 Hg 21.25226748 22.70554898 25.54396501 -63.77249198 -0.41531924 72.49410222 Hg 24.07236142 21.20379337 24.23854596 -37.43715805 -206.98304932 -54.84124948 Hg 25.26922180 22.28229695 24.02031036 175.12219782 72.31486524 -76.15217393 Hg 25.68745344 21.02015752 25.37970777 72.50312077 -62.27328980 61.25307915 Hg 24.29912821 22.37871118 25.25213077 -11.70512547 75.86006285 203.62232341 Hg 20.73125112 23.71824351 23.95250430 -79.32538166 13.81640998 7.29474408 Hg 22.18963501 25.62968218 24.21980528 35.01058291 70.21380685 -7.96516511 Hg 22.79977655 24.18543805 25.45460942 -138.17602632 -140.75836247 101.19606356 Hg 21.07327937 25.69989723 25.62961200 -53.86875833 27.30002291 61.07425079 Hg 23.87425859 24.14286682 23.76564846 24.09006642 23.17744854 -24.93980287 Hg 25.38507600 25.79768454 23.79716797 39.97284566 42.03212796 7.35690250 Hg 25.36065667 24.21465782 25.47011124 72.18953047 9.02526250 43.70605739 Hg 23.70220318 25.21755886 25.35541431 140.31335960 210.26128009 55.69360894