108 Lattice="11.91027200830251 0.0 0.0 0.0 11.91027200830251 0.0 0.0 0.0 11.91027200830251" Properties=species:S:1:pos:R:3:forces:R:3 energy=-359.09527030733676 stress="-0.008981477379686137 -0.0003549737717093019 0.00036317075458930587 -0.0003549737717093019 -0.008530685107164357 -0.0007523168901957836 0.00036317075458930587 -0.0007523168901957836 -0.008619926697205172" free_energy=-359.09527030733676 pbc="F F F" Au 0.03485291 0.02414492 0.01970149 0.81732771 0.82059060 0.83295702 Au 1.97684664 1.99843982 0.02355411 -0.31683620 -0.52540200 -0.44946677 Au 2.01352801 0.01321534 1.98135999 -0.51765845 -0.34851280 -0.41388257 Au 0.00598068 1.96135721 1.95256100 -0.26000619 -0.40761736 -0.22732556 Au 3.98732516 0.01758606 0.03796863 -0.02355678 0.39388169 0.36567399 Au 5.91972023 2.02264688 0.00383598 0.21927839 -0.59798386 -0.53105291 Au 5.94645862 0.01062042 2.01654387 0.00042861 -0.49192011 -0.49606424 Au 3.98294786 1.99118528 1.98540381 -0.17192178 -0.53728176 -0.44143029 Au 7.91723480 0.00845994 0.03373382 0.24453694 0.58199308 0.58915426 Au 9.89171534 1.96111641 0.03420287 -0.58067789 -0.26424656 0.56646369 Au 9.93016321 0.00330242 2.02441933 -0.62196928 0.63587045 -0.30783079 Au 7.91146183 1.96356034 1.94955828 0.61346041 -0.31264732 -0.34249001 Au 0.02962197 3.97013297 0.02349064 0.30432170 0.00949752 0.33262151 Au 1.95063356 5.98544005 0.01492166 -0.20918304 -0.05849964 -0.37941493 Au 1.98415635 3.95001563 1.94963132 -0.41013514 0.15229779 -0.13723327 Au 0.00810266 5.92484493 1.99957027 -0.36537307 0.04870054 -0.30881701 Au 4.00496831 3.95497228 0.01528992 -0.31454780 0.18869872 -0.65384888 Au 5.95014888 5.93191647 0.00619966 0.09975540 0.23217536 -0.40351409 Au 5.92536131 3.94994104 1.96683356 0.31918355 0.27630706 -0.16681091 Au 3.96867669 5.98222032 1.98017433 0.15176504 -0.27396298 -0.65260589 Au 7.94340965 4.02683148 0.03412436 0.29563505 -0.23080174 -0.58871697 Au 9.90656614 5.94251223 0.02716280 -0.40706525 0.16287740 0.40268797 Au 9.89439376 3.97186412 1.94613732 0.47251441 -0.16413941 -0.13115779 Au 7.94470641 5.92538437 2.01899921 0.28384018 0.32062578 -0.46211880 Au 0.03384533 7.93762718 0.02477189 0.55504786 0.27098664 0.63615924 Au 1.99142452 9.89919873 0.03236300 -0.31334323 -0.57579900 0.55422151 Au 2.00993100 7.91775833 2.00637359 -0.84483504 0.60083075 -0.83394069 Au 0.02171539 9.93651185 1.99896282 0.63348559 -0.66417515 -0.27662156 Au 4.01907964 7.96650466 0.03081588 -0.19742145 0.16109185 -0.57713325 Au 5.92896008 9.88606748 0.03648433 0.13892967 -0.18617455 0.29020263 Au 5.95739025 7.97685687 2.01230292 0.25881964 0.16411479 -0.49109313 Au 3.94042092 9.89974836 1.97944459 0.08850396 0.66877482 -0.30701829 Au 7.91329555 7.97769444 0.03112622 0.56370823 0.29005560 -0.09972113 Au 9.96059902 9.89350510 0.01412602 -0.97623788 -0.96117922 0.98881880 Au 9.94973836 7.91592151 1.97965617 0.04912586 0.52908208 -0.41519476 Au 7.94143731 9.95763859 2.00947797 0.53222522 0.11087324 -0.43538345 Au 0.00064759 0.01094358 3.95983063 0.52086780 0.52007437 -0.03183128 Au 2.01817357 1.95560781 3.97098626 -0.80056102 -0.09596214 -0.17477963 Au 2.00688133 0.00864146 5.93689694 -0.50741184 -0.62509250 0.08617740 Au 0.03698131 1.95337865 5.98263926 -0.37706913 -0.19377955 -0.08034037 Au 3.94007789 0.03485806 3.99834545 0.22726704 -0.87570582 -0.16822974 Au 5.93340018 1.97002778 3.96101065 0.15139039 -0.43235239 0.08631238 Au 5.92427989 0.02894702 6.01132777 0.19094164 -0.53540583 -0.13045781 Au 3.95057257 1.98056694 5.92923400 0.20058734 -0.12203117 0.30921690 Au 7.96962591 0.03913983 3.93795628 0.25169109 -0.52912795 0.17217225 Au 9.90187326 1.96624342 3.99476187 0.47503735 -0.22900342 -0.16971492 Au 9.96253625 0.02510990 5.94661421 -0.57861752 0.53348489 0.07378206 Au 7.93818467 1.98308283 5.94279299 0.50313406 -0.70666230 0.15840112 Au 0.02573289 3.90715157 3.98353138 -0.36712434 0.09580963 -0.06965685 Au 2.01003415 5.97963033 3.94027404 -0.64161181 -0.43262924 0.12865521 Au 2.01280252 3.98651506 5.92660289 -0.49354892 -0.13610349 0.15366140 Au 0.03906171 5.97812070 5.92361655 -0.55814392 -0.16281669 0.08199981 Au 3.99145656 4.00562399 3.93349375 -0.21877002 -0.13495236 0.19474171 Au 5.95028710 5.97390882 4.00625060 0.20135306 -0.13493431 -0.33245231 Au 5.97067269 3.95106382 5.91753815 -0.36207306 0.01036976 0.25385841 Au 3.96644944 5.98159139 5.97140230 0.05707863 -0.21066721 -0.02521418 Au 7.90433347 3.93939661 3.98031575 0.73397987 0.14772764 -0.18234927 Au 9.95725626 5.91571324 3.93336852 0.18083704 0.08946253 0.22617853 Au 9.94884436 3.93425264 5.96371749 0.31515689 0.18534530 -0.01987450 Au 7.93386634 5.92813574 5.99172307 0.89097931 0.17108841 -0.35560398 Au 0.03661948 7.95989640 3.97949643 -0.63342491 0.30824008 -0.16421690 Au 1.99358092 9.89436409 3.94048826 -0.38548899 0.63006317 0.05875476 Au 1.97107059 7.92102111 5.94285530 -0.31475559 0.61918857 0.17937399 Au 0.03953256 9.95209179 5.87837299 0.43241487 -0.45344614 0.13949371 Au 3.97270533 7.91350559 3.93126862 0.14355525 0.70208409 0.49565734 Au 5.93387964 9.93789028 3.97353070 0.09214543 0.38102847 0.13676978 Au 5.98669351 7.90881370 5.93036359 -0.13101867 0.85968432 0.25095108 Au 3.90468929 9.93193892 5.92523783 0.24057217 0.23924033 0.14887447 Au 7.95430855 7.94672766 3.93826323 0.66679494 0.45932459 0.30621123 Au 9.89867433 9.94027911 3.94130037 -0.55627103 -0.60675881 0.04998350 Au 9.93587182 7.93408003 5.98905456 0.04152609 0.39027557 -0.17248009 Au 7.91700835 9.94872359 6.00010882 0.47393734 0.06150852 -0.14995298 Au 0.02879399 0.03214890 7.90882283 0.50536340 0.48681699 0.37627824 Au 2.01607063 1.92048812 7.94324754 -0.69454334 0.09089209 0.54314855 Au 1.97096060 0.01226903 9.93407171 -0.26693937 0.65215505 -0.58057462 Au 0.00229288 1.99354403 9.93182980 0.76098305 -0.22146377 -0.76619560 Au 3.95934956 0.02547273 7.97875534 0.08208143 -0.61026092 0.31373218 Au 5.96212803 1.97489144 7.95114488 -0.03550377 -0.40350862 0.39197089 Au 5.92313745 0.00851979 9.94123970 0.10015006 0.44956593 -0.49013652 Au 3.99268309 1.98608973 9.90513592 -0.04941781 -0.26545308 0.53857413 Au 7.97636328 0.00037606 7.96263033 0.36850878 -0.13496846 0.32690970 Au 9.91278853 2.01886533 7.97165027 0.26545348 -0.49381904 0.37814394 Au 9.90589072 0.03421974 9.91431616 -0.85770492 0.86246471 -0.85862367 Au 7.91191462 1.97676315 9.92194968 0.52742127 -0.36637134 0.29378250 Au 0.02972223 4.00393471 7.93822981 -0.37269264 -0.29785485 0.23192264 Au 1.99334319 5.92786198 7.95749399 -0.42893699 0.17779651 0.17631647 Au 1.98618156 3.99213530 9.88595731 -0.37268015 -0.32700233 0.53275044 Au 0.02154444 5.93111294 9.88867315 0.28997455 0.07438403 -0.30606080 Au 3.99025867 3.96598134 7.94480691 0.01730341 -0.07837725 0.30109426 Au 5.98007422 5.93198603 7.92966432 -0.27109438 0.09869998 0.54656113 Au 6.00217516 3.98667311 9.94656119 -0.14501951 -0.05356601 0.39383094 Au 3.95432852 5.92680663 9.94008133 0.17001239 0.11623966 0.36798002 Au 7.91256877 3.93692905 7.90065046 0.81844884 0.16618599 0.77115738 Au 9.96288639 5.99190246 7.94428495 0.12700229 -0.20921466 0.42354430 Au 9.95849420 3.92804834 9.95630500 -0.69254333 0.03971171 -0.68104207 Au 7.96025068 5.91285116 9.92309475 0.51814562 0.01999547 0.25876909 Au 0.03022985 7.96194388 7.95075569 -0.30110239 0.40855327 0.32528099 Au 1.95038606 9.94306395 7.92152183 -0.30791872 0.14048790 0.46449657 Au 1.97289662 7.90614679 9.89567436 -0.32492869 0.60692837 0.33436306 Au 0.01122639 9.92478636 9.90892452 0.91104699 -0.90049383 -0.91500877 Au 3.93603254 7.92714156 7.92783448 0.26603207 0.66174680 0.49992744 Au 5.96183974 9.92157053 7.92003220 -0.10716601 0.14256783 0.38846788 Au 5.95631197 7.91061397 9.88841812 -0.05256227 0.45572975 0.33486852 Au 3.97255363 9.91235016 9.89239773 -0.01701755 -0.57065611 -0.58213748 Au 7.94380888 7.90880939 7.97190638 0.55050105 0.68839384 0.36611336 Au 9.89432580 9.92704956 7.94370823 -0.67602742 -0.69438659 0.25913642 Au 9.90291827 7.95038254 9.94849772 -0.69537407 0.23283155 -0.71826289 Au 7.94945276 9.94542134 9.90968216 0.21426290 -0.75030182 -0.73422352