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=-57.75792674862618 stress="-0.000865674439830524 -7.360249688251277e-05 -0.00038585946668216205 -7.360249688251277e-05 -0.0010229520378143757 2.7447876287419173e-05 -0.00038585946668216205 2.7447876287419173e-05 -0.0008184631008152417" free_energy=-57.75792674862618 pbc="F F F" Si 35.22086729 34.98310996 34.77096654 -1.77756708 -1.02152422 -1.59811782 Si 36.59933616 35.93572417 35.98055861 -9.74337121 -24.92834055 18.94857449 Si 37.14715992 37.22516294 35.23402360 -1.91216279 11.35079307 -30.41307392 Si 37.93229823 38.31172061 36.19084223 13.05717757 16.67670545 11.96008369 Si 37.29465675 35.14771729 38.20399864 -11.41105696 -4.48158158 -5.46469555 Si 38.85840215 35.76443239 39.02546443 10.95198375 6.49052312 -2.52059659 Si 34.95577374 37.79563377 37.93187189 -2.55504906 -1.73436352 -4.53829827 Si 36.55604684 39.07636534 38.99475015 -26.99127032 54.47431017 -32.34543598 Si 40.78248547 35.50979054 35.01871475 0.15108799 0.56593143 -1.78205377 Si 41.20935311 36.04524550 37.00114475 -0.41211013 -1.26819556 -0.00304171 Si 42.56413860 37.42957765 34.86420263 -8.05613154 -6.09885034 -5.14686889 Si 43.67982227 38.56376137 35.86736005 5.72918190 6.44904872 6.09452275 Si 42.81964364 35.29825864 37.98568119 -10.94692804 -14.42142946 -8.12992683 Si 43.94092265 36.27545454 38.76617260 20.72429328 8.47790755 2.38904480 Si 39.91968061 37.62700696 36.94707193 -5.24510264 0.10522133 -11.65735003 Si 40.45589851 38.21165048 38.60464577 5.44399521 4.61412996 11.60104535 Si 35.19056740 39.70676063 35.45558802 0.72215470 -3.30141085 0.31614835 Si 36.49928622 40.79692580 36.73410168 -3.62774685 6.57403777 -5.15320191 Si 37.49728798 42.21972589 35.09651729 -2.81481811 -3.05820027 -1.49333379 Si 38.61643991 43.32327578 36.40123177 -33.58170705 24.95522058 -22.25571893 Si 37.95366604 39.88968876 37.71888199 -8.84107268 -10.70464850 -11.68565514 Si 39.18297782 40.79320854 38.39174556 18.41004930 13.02165304 8.44401387 Si 35.34278350 42.83814538 37.63905551 -3.37137817 -10.57721657 -22.04887204 Si 35.60366252 43.53906159 39.11824152 5.26168583 8.60581302 22.16113937 Si 40.36229702 39.99389056 34.77599447 0.00247412 -2.35691757 1.99750281 Si 41.60365422 41.12475624 36.46651109 -13.83343231 15.67791233 -12.92051088 Si 41.67119966 43.29253646 34.78221554 -0.28335902 -1.18182856 2.20298331 Si 43.57559210 43.55058575 36.17451505 -1.19397598 -0.91059183 -0.37836972 Si 42.58087455 40.09122498 37.35935114 12.00632307 -15.28962175 12.01578922 Si 43.97462727 41.11272182 38.87984742 -1.10628506 -0.02732839 0.76996096 Si 39.66448343 42.68403127 37.11226018 37.78104635 -22.92457593 23.21598147 Si 40.97555741 43.31914392 38.89352680 -19.52394215 7.70183461 -9.21225640 Si 34.77045360 35.28866239 39.68786656 -2.99766152 -2.79108543 -3.90400422 Si 36.11803101 36.55239207 40.36469048 -6.19382065 -12.19873749 12.66618642 Si 37.00297454 37.99791377 39.62151619 37.74312678 -48.14751272 32.36156228 Si 38.55150311 38.51894432 41.34725891 -4.40458793 -8.23170162 10.02998831 Si 37.43970136 35.30962604 42.02044147 -3.73643589 0.56554793 1.72106463 Si 39.08450338 35.75571598 43.58475277 -7.99414965 -8.54800071 6.62676611 Si 34.99655912 37.96978731 42.51668654 -6.41117186 -5.93889982 -8.23808376 Si 36.22422232 38.91950201 43.54655608 -8.10653263 -8.57375464 15.76327509 Si 39.08532250 35.00206044 40.83625574 5.10051330 -3.42757263 3.13867605 Si 41.48837336 36.00831489 41.43404765 -23.18008849 35.47425600 -19.69072897 Si 42.84911873 37.01595790 40.07449325 -10.92415322 -0.61191342 2.65624809 Si 43.60556472 38.49425818 41.03735392 2.97085798 8.20515205 4.26175537 Si 42.20384740 34.85081933 42.03810700 24.45294575 -36.30308762 20.77221087 Si 43.75567948 35.58042468 44.03850275 -1.28538136 -0.45156438 -1.64546058 Si 40.09980901 37.00409575 42.77385137 6.03379144 9.73798012 -6.81742024 Si 40.45001924 38.68012147 44.06439877 4.92063109 -3.58131758 1.23150161 Si 34.67279202 39.50987893 39.48578789 -10.08981197 5.38494375 3.50196667 Si 36.08758896 41.54075235 41.27599980 0.73025015 -1.70952298 -0.61586346 Si 37.82350393 42.21827495 39.80335328 -9.92943449 -10.87224598 -11.09268798 Si 38.63834321 43.28337470 40.87827378 10.55914085 11.03668262 10.99634923 Si 37.36102597 39.94186987 42.87644269 15.42369928 14.20103819 -10.48835756 Si 39.48039759 40.39396702 43.96640764 -3.62975799 6.52392434 -1.32921414 Si 34.85019353 42.97085593 42.41342367 -3.82173119 -0.37657311 -2.73040514 Si 36.40009545 43.42893138 43.60183795 3.53719422 0.90784497 2.40506035 Si 39.50493887 39.74812168 40.36805486 9.87674875 8.49562501 -5.77698342 Si 40.89974943 41.22892384 41.12165250 19.62121032 -27.75541292 -34.75807917 Si 42.34497277 42.80178516 39.71375535 19.28999624 -8.08645810 12.65229152 Si 43.52483290 44.05828627 41.79540240 -2.70464561 -1.95557508 1.49613955 Si 42.53145179 40.69547502 42.81686792 -3.86039132 -5.78668780 -4.05636424 Si 43.70438034 41.68532165 44.08892020 1.70499802 5.24194837 1.79572918 Si 40.39757659 42.11536967 42.13716159 -18.52705517 30.25837407 36.32939687 Si 41.35575003 43.97629211 43.72804991 2.81872087 -2.14011010 -2.63192757