64 Lattice="70.0 0.0 0.0 0.0 70.0 0.0 0.0 0.0 70.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=2.2321492383108246 stress="-0.0004935645947235923 0.00022745802115080747 -2.5424579469023146e-05 0.00022745802115080747 -0.00044603808564199404 9.175800355083372e-06 -2.5424579469023146e-05 9.175800355083372e-06 -0.00029530112042866046" free_energy=2.2321492383108246 pbc="F F F" Au 35.07742389 34.80766102 35.20177176 0.70119583 0.11454404 0.49765787 O 36.77827796 36.88793279 36.48397328 1.95578821 2.53382740 -10.28709347 O 37.19947704 37.26585771 35.12414001 -3.12247247 -3.67184803 10.13671489 O 38.84355442 38.62276968 36.08924335 2.44802355 2.06228825 0.44094691 Au 37.36557685 35.05948738 36.77791651 0.18653156 1.09241335 -0.86189732 O 38.62099372 36.67903887 38.50881642 3.87036206 0.50585424 -5.20629674 O 34.76074070 37.80123457 36.77155293 0.70246334 0.41228447 1.53522822 Au 35.83905584 38.82359302 38.71471096 9.91716582 -9.38973252 -16.42512285 Au 39.79414851 35.07882301 34.68911166 -0.41297950 0.45591219 1.54168046 O 40.57016351 35.83968490 36.12744227 -0.16046282 -0.99639236 -0.94723558 O 42.43344992 37.82690065 34.68112761 2.70082008 1.13142751 1.78421527 Au 43.82823055 38.56962328 35.90482951 -2.35694678 -1.18133659 -1.93130270 Au 42.57641902 35.08887585 38.35247011 0.83070253 2.18214302 2.13327016 O 43.85640665 36.44288939 38.93478536 -1.73798786 -1.40531210 -0.72600111 O 39.58004603 37.42291825 37.61138709 -4.34341336 -0.85583264 4.45064357 O 40.96322446 38.71160067 38.72858925 0.80833121 -0.56502487 1.30588033 O 34.76142812 40.54408705 35.44347574 -0.17726805 -0.00951229 -0.39729863 Au 36.00522559 41.65429937 36.12210135 -18.85431981 -7.52500715 7.61756086 Au 37.60299683 42.46836453 35.35886605 18.26072892 9.85974741 -6.44657924 O 38.85533805 43.89713963 36.49814317 -1.29472416 -2.05611471 -0.42492955 Au 37.77221949 40.33737120 37.60231780 -11.05858356 -10.01198294 -10.77259928 Au 39.12283489 41.27776773 38.66501309 -14.42010314 11.98697114 11.75677838 O 34.88292486 42.36325129 37.54483978 1.29227880 0.07463954 -0.34009900 Au 37.09358153 43.34744782 38.33347222 -1.63487692 5.84793636 -16.75949877 O 40.18261332 39.51911666 35.35764363 -2.71402369 -1.55812374 0.96970723 O 41.60597799 41.98844663 35.77630361 -1.60279580 0.00388348 1.39034154 Au 41.97135239 43.40618724 34.84451727 2.74368815 0.31266747 1.19411431 O 43.85781273 43.22712174 36.00706128 -2.00052775 0.53705870 -1.54198832 O 42.03576203 40.46589262 37.67677334 0.18808863 1.04245363 1.05067144 Au 44.00238673 41.08193849 39.12229896 25.39970392 -33.09797670 -12.96300865 Au 40.41557061 42.07623522 37.42472124 14.44445461 8.52070343 -14.99684834 O 41.30058484 44.05071827 38.97410939 0.85162887 -1.28288059 0.17857924 Au 35.09315700 34.81687584 39.73281308 1.84534079 1.79709155 1.11048943 O 35.39627297 36.62695035 41.77301755 1.44663137 -2.58619742 -2.08929330 Au 37.39349841 36.82236347 40.07736874 -1.21517571 0.19834639 0.39629317 O 39.24228883 38.94750569 40.72329120 1.08369380 0.71940698 0.64561735 Au 37.30026185 35.29553482 42.57991674 -2.47949668 -0.37542973 -0.94316508 O 38.51069070 36.38785104 42.95946612 3.42841155 2.43246788 -0.19057783 Au 35.22265454 37.62776604 43.08672763 0.68403949 3.25934923 1.04429650 O 35.85076264 39.41617031 43.66305644 -0.48461135 -1.78391669 -0.63118873 O 40.32709439 34.67434156 40.01210830 2.57239132 1.26689026 0.97915328 O 41.81105207 35.60369202 40.82721022 -1.86020494 -1.10391766 -0.67981289 Au 41.79140576 37.49167613 40.14281568 -1.07640321 -2.35188061 -2.07450109 Au 43.88423686 38.87245546 41.10593507 11.37037221 -11.59277396 -13.23939886 O 41.85330807 35.23798788 42.77208573 1.13259123 1.50304033 -1.35778743 O 43.52890518 36.42139871 43.43726065 -1.06415708 -0.86931967 -0.37726981 Au 40.28666267 37.67616740 42.63624391 -1.63212801 0.75694937 1.46784837 O 41.42301430 39.12146443 43.76469610 -0.07661170 -0.84960041 -2.59987782 Au 34.75512234 39.58435622 40.12133246 -11.27859500 8.14350234 16.10381176 O 36.24309786 41.88926377 42.15104191 3.20561536 -1.67578827 -3.60296284 Au 37.29715911 42.64534720 40.20357008 -0.35766804 -6.72696552 14.74525155 Au 39.19138345 43.50058087 41.68113249 -38.74173925 55.92860680 -26.77033309 Au 37.02269163 40.53988913 42.77549515 -27.57689871 -20.60153338 -17.12670704 Au 38.31729992 41.30926057 43.63465067 26.48907466 14.83537417 21.52394792 O 34.83312722 42.91757855 42.05480916 -4.80219722 3.16122243 0.46827368 Au 36.11491922 43.42212538 43.34359694 -0.52372614 2.49104218 1.05879137 Au 40.49135582 40.34836566 39.64981165 15.07989048 -12.32130744 13.24594658 O 41.88022526 41.31198461 40.92125693 -0.05557485 -0.67404571 -0.11801263 Au 42.99568208 42.33895030 39.60241932 -27.68803541 33.62975431 13.58015006 Au 43.76229922 44.01053741 41.68860360 -0.16652648 -0.49591514 -0.53569578 Au 42.94742692 40.01270000 42.36415287 -12.62977824 12.50216951 13.48340976 O 43.59762219 41.19243628 43.54660354 0.22431727 0.20392540 0.20968382 Au 40.00343158 42.39062452 42.25124925 44.07231745 -53.70386864 25.55423866 O 41.56164883 44.01443174 43.91172957 -0.33562940 -0.18635726 -0.23681016