108 Lattice="11.798502973398636 0.0 0.0 0.0 11.798502973398636 0.0 0.0 0.0 11.798502973398636" Properties=species:S:1:pos:R:3:forces:R:3 energy=-362.9850716001589 stress="-0.007804902350440694 -3.198656091404836e-05 -6.166963640821006e-05 -3.198656091404836e-05 -0.007457122768442331 -0.00024251831204913314 -6.166963640821006e-05 -0.00024251831204913314 -0.007830817227283054" free_energy=-362.9850716001589 pbc="F F F" Au 0.02751859 0.03424697 0.00154170 0.89878238 0.83197944 0.90382635 Au 1.97192111 1.93697733 0.03343098 -0.30777947 -0.16272576 -0.36756317 Au 1.98403607 0.00704213 1.97993275 -0.33041346 -0.21589619 -0.26413319 Au 0.01643779 1.95264691 1.93913559 -0.20756042 -0.18468867 -0.18468370 Au 3.87981439 0.00585960 0.01232061 0.11349404 0.48613561 0.52643805 Au 5.90954329 1.94951961 0.00984762 0.11762204 -0.33444633 -0.57136645 Au 5.94057381 0.03831274 1.96978203 -0.13111716 -0.60587973 -0.39708960 Au 3.98597216 1.97617889 1.94436745 -0.45621957 -0.48777704 -0.16024406 Au 7.88187256 0.02105889 0.03495541 0.25728831 0.60042599 0.57332525 Au 9.85398904 1.95369008 0.02177791 -0.71337388 -0.10698329 0.68254845 Au 9.85398682 0.03462386 1.97495174 -0.73904829 0.66558465 -0.13908150 Au 7.89162451 1.95517514 1.93306083 0.54093756 -0.19716695 -0.14181636 Au 0.03141038 3.94698818 0.00683696 0.51157545 -0.11329428 0.49522833 Au 1.96536243 5.91450906 0.01354189 -0.25681605 0.07752896 -0.35521265 Au 1.99276101 3.93459525 1.95041369 -0.50746621 -0.32930893 -0.28593672 Au 0.01305733 5.85343063 1.98464356 -0.46856046 0.19702286 -0.49636347 Au 3.97095275 3.92277766 0.00366747 -0.22318444 -0.05880255 -0.71298319 Au 5.86850349 5.95785423 0.01880538 0.36310391 -0.15047851 -0.68670135 Au 5.92606450 3.94105910 1.93416894 0.16101175 -0.04362574 -0.19174859 Au 3.94854349 5.86540377 1.93508486 -0.21477630 0.37421244 -0.15248322 Au 7.88971614 3.94449083 0.00355880 0.25534508 -0.07931874 -0.37371967 Au 9.81026836 5.86539907 0.01762073 -0.44469565 0.17811206 0.47056674 Au 9.84476476 3.93393488 1.95799661 0.27250106 -0.17518812 -0.21100956 Au 7.89457093 5.92337267 1.98328900 0.44014872 -0.27765728 -0.66481860 Au 0.03058437 7.82933057 0.02720218 0.66377299 0.25322693 0.71527317 Au 1.99225179 9.81786316 0.03367074 -0.22113382 -0.70228741 0.73540494 Au 1.93806520 7.89982685 2.00418022 -0.13463024 0.35761756 -0.82858390 Au 0.00302029 9.81221767 1.95912360 0.73492646 -0.70103230 -0.13248297 Au 3.95087813 7.89495622 0.03705884 -0.27910107 0.35279646 -0.33881170 Au 5.87887114 9.81761742 0.03416989 0.11633510 -0.42287254 0.43511374 Au 5.92324122 7.85249080 2.00103599 -0.29259103 0.58834699 -0.76162989 Au 3.96638666 9.86935761 1.98722114 -0.15448836 0.24680707 -0.36985807 Au 7.85697930 7.88674812 0.02263592 0.37236728 0.27437495 -0.38560876 Au 9.80308747 9.84835369 0.03410628 -0.88047904 -0.86814234 0.86705742 Au 9.80118641 7.90414761 1.94541876 0.49640208 0.14464077 -0.29506557 Au 7.85526481 9.82139670 1.97644795 0.35120351 0.51982602 -0.46794376 Au 0.01510911 0.03780013 3.93081426 0.40837134 0.40342055 -0.05052960 Au 1.93991525 1.93824319 3.97160580 -0.11919498 -0.11669527 -0.52112188 Au 1.98166596 0.02748216 5.88903519 -0.36601123 -0.64449316 0.17923950 Au 0.03305894 1.97302708 5.93590038 -0.75075583 -0.43507210 0.01274628 Au 3.96502015 0.03045845 3.95657242 -0.19405082 -0.68395666 -0.34435797 Au 5.90036820 1.97485451 3.94146102 0.23270134 -0.20435642 -0.23672444 Au 5.86589482 0.01661286 5.91373313 0.36584190 -0.78388577 0.14351938 Au 3.97939202 1.95240792 5.89657143 -0.42249884 -0.12715627 0.08253684 Au 7.84182328 0.02852744 3.94628165 0.51703414 -0.51080833 -0.13621405 Au 9.83842706 1.94137139 3.95006774 0.22020480 -0.13915065 -0.11461344 Au 9.80915627 0.00946686 5.90078790 -0.44354783 0.47370310 0.04340603 Au 7.83898187 1.94420018 5.89652216 0.67428789 -0.14923783 0.22024384 Au 0.03509689 3.94910148 3.96072062 -0.62159376 -0.19442101 -0.21634394 Au 1.97121720 5.92379477 3.89145480 -0.22069978 -0.19299823 0.32899219 Au 1.92030166 3.91840921 5.92599858 0.14402475 0.27813174 -0.13196001 Au 0.00625895 5.91217300 5.92274784 -0.58208402 0.13473780 -0.04397035 Au 3.94420319 3.94394461 3.97130417 -0.24663506 -0.12158259 -0.26938300 Au 5.89981816 5.92787982 3.94628673 -0.12684356 -0.32259837 -0.29792195 Au 5.88489645 3.96656911 5.94444936 0.24359553 -0.30993373 -0.30575908 Au 3.95773119 5.93073102 5.92653736 -0.52044560 -0.30581814 -0.24079957 Au 7.84559799 3.96478462 3.95816379 0.64233016 -0.42143153 -0.27656941 Au 9.86690920 5.86218790 3.94561266 0.45360231 0.19265576 -0.18585056 Au 9.83634789 3.93888418 5.89861746 0.33909625 -0.14218098 0.19261933 Au 7.84737950 5.92005064 5.87814456 0.84952873 -0.11108041 0.33231545 Au 0.03808146 7.83438560 3.93176135 -0.57468097 0.64323806 0.08708435 Au 2.00173195 9.84678982 3.91837573 -0.60583274 0.36749355 0.07669552 Au 1.97879696 7.85906509 5.92268870 -0.66628881 0.70669356 -0.35628310 Au 0.00585021 9.86065344 5.91007680 0.69678359 -0.72571021 -0.02635731 Au 3.94123819 7.87939679 3.94537731 -0.18125725 0.40015238 -0.24139193 Au 5.93373480 9.80645623 3.93312827 -0.11735430 0.76952251 -0.00796811 Au 5.91466321 7.83572081 5.90478050 0.00472714 0.86062048 0.05718174 Au 3.94213199 9.86238241 5.86191823 0.01913993 0.43724680 0.19863338 Au 7.85236231 7.84905939 3.88822427 0.89992746 0.56823936 0.34364678 Au 9.81026984 9.82595926 3.88562405 -0.49798783 -0.51356760 0.08149651 Au 9.81289867 7.83108323 5.86198163 0.42675604 0.62395154 0.13138512 Au 7.84238771 9.81217231 5.87356605 0.70199790 0.41720300 0.12389007 Au 0.01799682 0.00884114 7.82835744 0.76720847 0.75230806 0.33087431 Au 2.00299479 1.98068459 7.83642694 -0.71194114 -0.55357591 0.96922813 Au 1.94066180 0.00935291 9.81589192 -0.14099318 0.87822110 -0.84225935 Au 0.00076382 1.96274115 9.82027903 0.92718476 -0.13543725 -0.91403028 Au 3.94489211 0.03036874 7.86570848 -0.16427472 -0.55101783 0.55516196 Au 5.89182044 1.98568195 7.88196548 0.34844185 -0.68290800 0.50598882 Au 5.91210891 0.03273498 9.83938967 0.05884434 0.50436358 -0.56479686 Au 3.94966698 1.99456101 9.81712770 -0.28675503 -0.55515538 0.57064399 Au 7.89974869 0.01078583 7.86830477 0.15276079 -0.25809507 0.33260214 Au 9.83938643 1.95754439 7.85336382 0.11269806 -0.13338558 0.36259928 Au 9.81785133 0.01128901 9.80952193 -0.85600837 0.90450413 -0.88672812 Au 7.88514936 1.94678038 9.81096440 0.37810246 -0.18124210 0.26057165 Au 0.01020466 3.96293858 7.85947051 -0.39784961 -0.18384126 0.64894412 Au 1.96417037 5.93818402 7.85142576 -0.38905882 -0.34439844 0.63383463 Au 1.98234436 3.96957146 9.84992451 -0.51232514 -0.26644750 0.17681015 Au 0.03747014 5.93492487 9.81519808 0.43971189 -0.02206341 -0.42115419 Au 3.95862966 3.92298819 7.87795651 -0.43300493 0.21771507 0.48996010 Au 5.88980458 5.90366491 7.85485925 0.17314148 0.19225330 1.01129481 Au 5.89201840 3.90721005 9.86166397 0.17948921 0.22027012 0.51413575 Au 3.88589038 5.91089930 9.85567558 0.25365290 0.02234636 0.40003719 Au 7.82709339 3.95722384 7.87802963 1.03490159 -0.18966792 0.49793224 Au 9.87030495 5.92427612 7.85571367 0.14632090 -0.10180979 0.43137408 Au 9.85314755 3.90922965 9.86309250 -0.74312496 0.00866164 -0.82251174 Au 7.89440017 5.91845358 9.79919128 0.37286006 -0.02930201 0.39514154 Au 0.03551897 7.89369502 7.90238517 -0.43659138 0.42574093 0.19116832 Au 1.99893188 9.80528683 7.83168937 -0.45692538 0.49093252 0.45823942 Au 1.99108432 7.86758033 9.82048189 -0.34636209 0.53532671 0.38711606 Au 0.02420897 9.82081820 9.84319469 0.97452026 -0.91782717 -0.95273909 Au 3.92452366 7.85806074 7.83616776 0.23394933 0.77426098 0.85945986 Au 5.93473298 9.80154429 7.82767974 -0.13297977 0.42134719 0.59431963 Au 5.90754428 7.84458994 9.83270043 0.01132620 0.50765496 0.18549990 Au 3.91596655 9.86324953 9.79282797 0.07798036 -0.69252400 -0.60403696 Au 7.89573020 7.88000957 7.84822629 0.56806988 0.41827685 0.69651213 Au 9.81904492 9.86157920 7.91983722 -0.78780045 -0.92056392 0.01021818 Au 9.83639536 7.86641696 9.86052799 -0.79531606 0.20026811 -0.88214358 Au 7.89844598 9.83814094 9.79725421 0.09457545 -0.80713003 -0.67862364