108 Lattice="11.682653500289074 0.0 0.0 0.0 11.682653500289074 0.0 0.0 0.0 11.682653500289074" Properties=species:S:1:pos:R:3:forces:R:3 energy=-339.1063401263639 stress="-0.00838779487873811 -0.0007837027819266943 0.0008062467420453258 -0.0007837027819266943 -0.008370252356169311 0.00017011412172529617 0.0008062467420453258 0.00017011412172529617 -0.008062059734992228" free_energy=-339.1063401263639 pbc="F F F" Au 0.01478639 0.02753309 0.01556914 0.52039101 0.44241775 0.52640106 Au 1.92925601 1.97338306 0.03177154 0.15656157 -0.12924425 -0.13536883 Au 1.99598830 0.01983992 1.98345925 -0.25778044 -0.22765080 -0.18319922 Au 0.00584956 1.92168159 1.98226979 -0.16669477 0.15840405 -0.22985460 Au 3.85973016 0.02585596 0.02425346 -0.10272739 0.22908067 0.09509806 Au 5.85481508 1.91626487 0.00135206 0.05973434 0.32191461 -0.57731194 Au 5.83392372 0.03480592 1.88235952 0.23196823 -0.64126937 0.36471924 Au 3.93287764 1.90788530 1.92586171 -0.59142302 0.08822420 -0.15206538 Au 7.78150620 0.01766415 0.02981939 0.12159246 0.33002645 0.22409412 Au 9.75963167 2.00405699 0.02082106 -0.44221776 -0.14323164 0.36327395 Au 9.73098133 0.00983896 1.94121775 -0.49099026 0.55758363 0.19339120 Au 7.79155095 1.94429582 1.87916603 0.24057563 -0.11933441 0.42677346 Au 0.00288908 3.85878566 0.01660688 0.33049050 -0.03261738 0.41017746 Au 1.94476427 5.82757906 0.02913117 -0.03393636 0.23927425 -0.56297277 Au 1.95565142 3.87480240 1.94775236 -0.39458095 -0.24538495 -0.36858451 Au 0.02410831 5.87068429 1.88697419 -0.54954883 -0.12365549 0.19380179 Au 3.91231135 3.90908410 0.02735970 -0.19536244 -0.34506389 -0.66234416 Au 5.83460592 5.85236698 0.01020185 0.14302180 0.06469111 -0.57373175 Au 5.82444521 3.90159584 1.98326615 0.52583856 -0.41794675 -1.08298855 Au 3.87560960 5.84601551 1.95850640 -0.31448169 0.49930539 -0.69732360 Au 7.82201792 3.90657889 0.01488939 -0.24334107 -0.18033608 -0.49106779 Au 9.72196518 5.84265003 0.02539883 -0.28913633 0.17284107 0.34271355 Au 9.72773774 3.88784570 1.93301992 0.41188652 -0.07280813 0.05623456 Au 7.77115493 5.81130691 1.93579434 0.44032426 0.49418904 -0.10010466 Au 0.00530045 7.81725820 0.00294748 0.39071349 -0.26645267 0.29760093 Au 1.92715828 9.69672144 0.02073658 0.35888304 -0.24472534 0.35166900 Au 1.91650887 7.78955139 1.92496194 0.27766863 0.39725614 0.09368387 Au 0.01279189 9.71552532 1.91333301 0.42881614 -0.34278856 0.37788298 Au 3.91959688 7.82860035 0.01404564 -0.39614752 -0.04730660 -0.30092273 Au 5.80869691 9.77397782 0.03641291 0.23551656 -0.37899159 0.31320927 Au 5.82543321 7.80855747 1.92888410 0.37694620 0.37575747 -0.29901967 Au 3.90394594 9.75511345 1.98136578 -0.44350581 0.22158622 -0.31142118 Au 7.76072478 7.76463254 0.04579389 0.08478765 0.27317410 -0.17655131 Au 9.70699965 9.72589030 0.01849307 -0.52285805 -0.55932887 0.54345786 Au 9.68504539 7.76571342 1.98534460 0.04556980 0.16877084 -0.10604068 Au 7.76016974 9.77425101 1.94857393 0.13945341 -0.15585567 0.05335262 Au 0.01296170 0.01345404 3.86825178 0.30781413 0.25511451 0.09150144 Au 1.91791703 1.93889427 3.87653071 0.14748007 -0.18196516 -0.05252435 Au 1.95271866 0.03544620 5.83038441 -0.37114060 -0.56645733 0.21067680 Au 0.03348846 1.97091370 5.84814738 -0.40619035 -0.25133800 0.26089769 Au 3.91789803 0.00740564 3.91451920 -0.17907392 -0.67626567 -0.38423808 Au 5.82326556 1.97929491 3.90447721 0.53012185 -0.94874687 -0.50449128 Au 5.85311694 0.02219826 5.81985233 0.32640919 -0.66291732 0.42629044 Au 3.88363751 1.89896770 5.84563172 -0.25434738 0.12214611 0.21241769 Au 7.75323213 0.00982810 3.87190598 0.32876733 -0.13037517 -0.24403738 Au 9.72820432 1.97348362 3.88869189 0.23458495 -0.27880753 -0.24557310 Au 9.76654418 0.01518905 5.79888103 -0.57086026 0.47711445 0.14627007 Au 7.78682703 1.95744663 5.81404241 0.63054469 -0.47702796 0.53503807 Au 0.02770619 3.88619184 3.89619395 -0.83955419 -0.10519571 -0.33292272 Au 1.91495084 5.81073705 3.87021375 -0.17376647 0.58776613 -0.17126099 Au 1.95815901 3.91029069 5.84820316 -0.41682873 -0.56689109 0.30100427 Au 0.01888839 5.83441065 5.81649769 -0.60198289 0.35795954 0.44769163 Au 3.93033905 3.90399312 3.88664409 -0.92259214 -0.51834541 -0.18891706 Au 5.81807763 5.87815605 3.85123794 0.81023907 0.22467668 0.19897671 Au 5.82902068 3.90085667 5.81855991 0.51231503 -0.22986284 0.39637652 Au 3.91503725 5.81311044 5.85175789 -0.67314880 0.52495389 -0.10768308 Au 7.79122128 3.88483573 3.90068797 0.54394625 -0.08047749 -0.31115961 Au 9.71959995 5.81583176 3.88711104 0.42352332 0.36458037 -0.04870744 Au 9.74182274 3.90427800 5.86617426 0.51711680 -0.34359924 0.21803488 Au 7.80732067 5.84558160 5.89895443 0.20164024 0.14645988 -0.47889734 Au 0.03103195 7.80506619 3.88367835 -0.42026517 0.07522972 -0.23449255 Au 1.97675853 9.76256004 3.91466388 -0.31379362 0.16225931 -0.42453494 Au 1.94630869 7.79716046 5.80966564 -0.31082689 0.10419270 0.46873616 Au 0.00317910 9.70578722 5.81326084 0.36859030 -0.29638594 0.20502391 Au 3.92350622 7.79665298 3.92416989 -0.84762548 0.36282683 -0.67490201 Au 5.81972232 9.72880739 3.87795065 0.34263314 0.85222165 -0.00136808 Au 5.80801696 7.80486373 5.85159383 0.63338363 0.53326347 0.18883176 Au 3.89468045 9.70279743 5.83574124 -0.28281284 0.88589584 0.51687705 Au 7.75520731 7.84581201 3.91555662 0.55578053 -0.24029224 -0.39870637 Au 9.72891726 9.69957324 3.92797084 -0.31714202 -0.34729956 -0.19313710 Au 9.69912237 7.75604586 5.89924892 0.56723484 0.33622431 -0.16950325 Au 7.81066417 9.70767987 5.83982681 -0.08852697 0.53603812 0.33466460 Au 0.00606119 0.00978780 7.81164531 0.54168768 0.51471845 -0.20722402 Au 1.95860656 1.92350420 7.81173061 -0.47199170 0.10926077 0.09877925 Au 1.97274498 0.03090390 9.74978937 0.14280895 0.33589315 -0.48297631 Au 0.03065595 1.91436293 9.77270694 0.45525443 0.32001629 -0.60894476 Au 3.90729216 0.02544698 7.76254695 -0.09784538 -0.56122439 0.30156201 Au 5.86620236 1.98073329 7.78486234 0.21889023 -0.81168668 0.20690266 Au 5.81094455 0.02566057 9.72637719 0.28047286 0.37000399 -0.42519399 Au 3.90053897 1.93884051 9.70349726 -0.12820034 -0.14795386 0.50430279 Au 7.81257830 0.03338614 7.78915463 -0.16063559 -0.11678500 -0.15786390 Au 9.73543715 1.91868070 7.81332824 -0.03675942 0.39995879 -0.30201270 Au 9.76000626 0.02238411 9.70668208 -0.46404741 0.38593020 -0.37136035 Au 7.81182165 1.94597612 9.71432210 -0.06671871 0.08080124 0.13407913 Au 0.00378751 3.92012126 7.79911826 -0.09833570 -0.35809148 0.22378494 Au 1.97825234 5.82394581 7.79385791 -0.70172366 0.41391289 0.52146616 Au 1.97519294 3.85806533 9.74944440 -0.28589430 0.00054960 0.16513608 Au 0.00978417 5.82517374 9.74703044 0.52612353 0.10945876 -0.44195731 Au 3.93096619 3.89804536 7.79306183 -0.61643200 -0.39605966 0.53157596 Au 5.80621092 5.87746481 7.75071519 0.60180070 -0.03632182 1.32093472 Au 5.82571636 3.85589752 9.70937891 0.31510249 0.23437970 0.80922822 Au 3.86820490 5.85056086 9.76181492 0.05253487 0.21099851 0.50524002 Au 7.76401403 3.91795299 7.79273140 0.75186373 -0.38195253 0.45897863 Au 9.75788620 5.84674082 7.78475558 0.23168246 0.00606458 0.44467715 Au 9.74817708 3.91541119 9.76300547 -0.42840794 -0.19692562 -0.59554392 Au 7.81653143 5.80889469 9.75869467 -0.24917906 0.35789006 0.01279843 Au 0.05843467 7.80982965 7.81321309 -0.30644705 -0.49342090 -0.24920405 Au 1.91186603 9.69046825 7.81637887 0.51453109 0.25253963 -0.25711374 Au 1.92464407 7.80979064 9.76892486 0.28152415 -0.24438352 -0.06070169 Au 0.01396027 9.71747544 9.70293102 0.31773577 -0.32777268 -0.25712589 Au 3.89777076 7.75133384 7.78890507 -0.55584030 0.94725188 0.69982687 Au 5.83514241 9.75182760 7.79822875 0.15632973 0.20259997 0.15753418 Au 5.84502902 7.84954753 9.73702446 0.10913867 -0.28986607 0.21719687 Au 3.88459830 9.75705033 9.77169969 -0.11879365 -0.54390769 -0.59939199 Au 7.75351344 7.77238688 7.77167969 0.40646360 0.44966335 0.82134493 Au 9.70050256 9.73896731 7.82976928 -0.47861238 -0.58463905 -0.18547741 Au 9.72258129 7.75129793 9.73693894 -0.54570178 -0.04073913 -0.55021626 Au 7.80231029 9.72097748 9.76815592 -0.17003238 -0.53733921 -0.59195534