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=-34.25458631772908 stress="-0.002107342257625456 -0.00017689331698265685 -7.916998953018151e-05 -0.00017689331698265685 -0.002089533843512715 -0.00019115758681009394 -7.916998953018151e-05 -0.00019115758681009394 -0.002088121787491084" free_energy=-34.25458631772908 pbc="F F F" Au 35.20933539 34.91552373 34.92107593 -1.37929141 -1.89429957 -1.56789037 Au 36.37123341 36.32960320 36.18317810 -4.10701725 -2.88241705 3.79943478 Au 37.55836248 37.38914869 34.87530399 -0.66100685 -1.86658244 -14.07979553 Au 38.67947958 38.60929236 36.16275730 4.34223315 2.71219635 -9.85000231 Au 37.62093273 34.87981805 37.43663081 -3.25729794 -8.16318067 -2.76428295 Au 38.81289135 36.31168298 38.53844138 -9.67576570 -22.32331462 8.15746054 Au 35.06052890 37.46730925 37.65113779 -7.17722990 -3.64115243 -1.96256746 Au 36.36083131 38.82465884 38.77482416 -9.48437407 -11.42543109 7.35893627 Au 40.06746919 34.99795515 35.01291389 -3.55882850 -2.61791141 -2.56882997 Au 41.32244694 36.27986131 36.26490791 -1.62329842 -1.68439139 -4.46776280 Au 42.36171090 37.57241516 34.96004608 2.08530015 3.72795299 -7.24408245 Au 43.73225899 38.69688417 36.26383728 7.43978097 -4.00901757 -4.00158210 Au 42.47523835 35.08350277 37.52352837 3.78586214 -8.98058742 4.31749917 Au 43.76459220 36.21353477 38.76315351 5.55960643 -0.77077501 -0.85018506 Au 40.00910121 37.56258143 37.55562750 14.38574837 11.41013759 -12.63736811 Au 41.31091207 38.84772527 38.76450144 -9.77350393 -9.81154425 5.80595005 Au 34.94132387 39.92210629 34.96456103 -1.05113308 -2.13840536 -1.26203875 Au 36.23362517 41.29360580 36.34981989 0.80975276 -7.50236811 -5.64056730 Au 37.38565572 42.46240812 35.06003690 3.82373359 3.33544257 -6.72381918 Au 38.61741131 43.83709561 36.27649019 -1.30881594 3.17708705 -0.75169461 Au 37.56777253 39.86299357 37.51688644 6.33987094 10.39187992 -13.97698647 Au 38.63923786 41.22571247 38.82570336 4.41364259 3.32597462 1.71213848 Au 35.05878935 42.51599876 37.48073357 -14.00469305 3.13231583 2.47076956 Au 36.05125193 43.79979825 38.69377056 2.93717993 8.26451091 3.57887912 Au 40.13035806 40.08863032 34.97552100 -3.02852077 -2.20052679 -6.78576321 Au 41.34364616 41.15803333 36.36476725 -6.55192574 8.02799108 -4.35844216 Au 42.45732256 42.59972581 35.12469926 -4.03212440 -2.48673722 -11.27462145 Au 43.64532561 43.74649970 36.16646781 7.55235320 7.22295270 7.20350180 Au 42.50210659 39.88997842 37.57440880 20.49487086 5.85801768 -13.12780264 Au 43.78480155 41.18490095 38.65341901 11.41269532 4.59267736 3.35632513 Au 39.98001556 42.60879645 37.59263590 -7.21599849 -3.62496851 -9.63587059 Au 41.24136253 43.63394628 38.83223540 -6.39333407 23.47761624 -4.13764410 Au 34.98826867 35.12517554 39.99985609 -2.68236077 -1.84011553 -3.58289598 Au 36.36591692 36.16191145 41.32342168 -4.09707562 -2.28119222 -2.33302038 Au 37.59833731 37.37931258 39.95348201 -2.68814553 0.42949837 4.55249262 Au 38.69870552 38.79883269 41.36533619 9.90451761 -23.94330303 -11.53013524 Au 37.63322374 34.99850197 42.52593737 -2.56183976 -17.64322926 -3.42784467 Au 38.68714826 36.24568188 43.65410892 -0.84628236 1.79366216 18.85728752 Au 35.05515173 37.39143725 42.50674681 -12.29532272 -3.04196423 -2.25174987 Au 36.09645554 38.66490979 43.63914602 4.01180533 5.80775455 9.24623126 Au 40.00410779 35.03122165 40.05487102 -1.05617111 -5.85326338 -0.45149565 Au 41.34706604 36.29432097 41.37391709 -3.09830772 -9.36605181 -5.48259306 Au 42.41067444 37.53221148 40.03407469 6.79657201 -7.40766864 -8.06544965 Au 43.66884170 38.65996567 41.18511125 13.93014656 6.72420079 7.34918805 Au 42.50583387 35.07179450 42.55274787 1.55875431 -19.23429927 1.10515149 Au 43.65691851 36.07431135 43.76954712 8.87424213 8.38656846 9.38323482 Au 40.00309973 37.41739604 42.52956152 -2.57240309 4.71680817 3.44101228 Au 41.18641147 38.70220522 43.73781989 4.31436985 4.53057454 9.38177228 Au 35.06281590 39.90170917 39.98560738 -12.95421616 4.91679330 5.82073173 Au 36.18378166 41.29275059 41.42727234 -7.28539309 2.89240663 -6.73674833 Au 37.44103146 42.55493917 40.07367816 -5.04257878 4.59820438 -2.17367623 Au 38.76482917 43.69390545 41.29222342 -2.42685350 12.91712263 -2.91766726 Au 37.57669660 40.02545517 42.37513336 -15.75196067 12.25076190 23.55039058 Au 38.69825167 41.32955636 43.73063782 -0.79668267 0.44636234 12.02109987 Au 34.93527767 42.48520304 42.54801945 -9.00719870 6.26140146 5.77890654 Au 36.11539788 43.77142591 43.73617448 1.79665409 0.87483974 0.73374186 Au 40.04333501 39.89265249 40.09769305 -7.47446482 3.69550344 -4.95450377 Au 41.15236074 41.21621350 41.27977597 8.45567183 10.03961384 3.86905847 Au 42.54106959 42.59974595 39.91899012 12.67648292 -11.38304260 10.95420029 Au 43.70277691 43.74595506 41.24186477 3.85659269 3.63577662 5.36434608 Au 42.55365159 40.08535422 42.55410985 3.91909368 -0.23206689 3.90035119 Au 43.85010535 41.15860068 43.82429769 1.76556300 2.29122040 1.77882476 Au 39.96121811 42.59690604 42.56599957 5.26014896 1.66357136 5.74329463 Au 41.33945155 43.73456981 43.75477575 4.41817119 2.72040984 2.98516846