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=398.77014937575836 stress="-0.004032465209205512 -0.000933143138400947 -0.0018131543686321935 -0.000933143138400947 -0.00473123492897873 2.3552709959207462e-05 -0.0018131543686321935 2.3552709959207462e-05 -0.0035108078403077495" pbc="F F F" Au 35.22086729 34.98310996 34.77096654 -9.85034460 -6.84116445 -8.57039609 Au 36.59933616 35.93572417 35.98055861 -27.86196472 -78.65018885 55.44414786 Au 37.14715992 37.22516294 35.23402360 -3.87237778 29.83907104 -98.47592960 Au 37.93229823 38.31172061 36.19084223 40.25773301 49.35167057 41.47848416 Au 37.29465675 35.14771729 38.20399864 -3.23507106 -3.93388797 0.28380602 Au 39.35802973 36.07349581 38.45018589 -16.45121806 -48.06075946 8.01969200 Au 34.76884260 38.20444678 38.02575960 -6.43033829 -3.26062897 -4.25234448 Au 36.55604684 39.07636534 38.99475015 -86.33611719 207.16525807 -117.04983401 Au 40.23975440 35.55577733 35.25284888 -9.66095410 -3.30274104 -9.82850158 Au 41.57116719 36.00454661 36.78983070 0.52886834 4.28051055 0.42418324 Au 42.51432400 36.93324962 34.86420263 -25.15041157 -25.28155300 -23.13324852 Au 43.67982227 38.09302613 35.62638390 28.30820166 27.72216033 18.18419045 Au 42.65159611 35.29825864 38.42293683 -32.82302928 -29.46389605 -17.00835390 Au 43.94092265 36.05152797 39.34850074 46.29997096 15.97461990 24.53726970 Au 39.98838261 37.59296640 37.93664450 -58.49134610 0.37238912 -57.88592739 Au 41.18847474 38.43667420 38.53414661 80.78394472 52.92273820 37.62056970 Au 34.71438530 40.36150737 35.14218700 -69.49144245 -24.52559551 -66.20502161 Au 35.83966317 40.75635164 36.21696173 66.82642178 16.68414514 66.94292627 Au 36.92616544 42.30861451 35.01570212 1.25391123 3.47321979 -5.55177725 Au 38.61643991 43.32327578 36.40123177 -140.37821839 88.37024656 -94.87761539 Au 37.95366604 39.88968876 37.71888199 -45.78315785 -28.18104645 -35.77967491 Au 39.18297782 40.79320854 38.39174556 53.68600066 48.00240966 16.12027853 Au 34.98481081 42.44102317 37.63905551 -5.18514456 -1.56846370 -2.85663900 Au 35.99862678 43.66349090 39.11824152 1.35688435 6.49044894 4.53404064 Au 40.19346698 40.68835026 34.69999199 -2.53993542 -0.55621509 -2.74525113 Au 41.60365422 41.12475624 36.46651109 -40.75414442 45.37561866 -38.13613451 Au 42.15839543 43.30582563 34.81780061 -6.28319302 -2.00488289 -3.96957858 Au 43.90115472 43.92104870 35.88926905 6.10275560 2.05188134 3.90488198 Au 42.58087455 40.09122498 37.35935114 27.50949043 -66.92709038 24.16571129 Au 43.62110655 41.43106942 38.19906879 21.29610467 20.95339341 12.62619817 Au 39.66448343 42.68403127 37.11226018 138.54238683 -82.88637189 88.76230943 Au 40.97555741 43.31914392 38.89352680 -55.74759289 25.55606119 -30.75167583 Au 35.05683674 35.46916971 39.29623789 -24.18305811 -14.28725469 -24.66740193 Au 36.17607196 36.20110399 40.58632960 18.86166281 6.56603112 28.18440199 Au 37.00297454 37.99791377 39.62151619 90.72650733 -208.46249783 118.12683114 Au 38.58185949 38.51894432 41.34725891 -3.86505119 -7.42339093 8.40002305 Au 36.58701770 34.91927757 42.62646796 0.29581582 -0.48460196 0.98888375 Au 39.08450338 35.75571598 43.58475277 -56.81432718 -109.28395269 51.15393601 Au 34.99655912 37.80971309 42.23712986 -7.93155852 -6.06457949 -6.83599455 Au 36.22422232 38.91950201 43.54655608 -45.79815082 -41.18314740 39.22160124 Au 39.08256643 35.20197720 40.33758909 -2.13511459 -5.66551027 12.36158509 Au 41.48837336 36.00831489 41.43404765 -72.82416956 114.14632996 -60.60817129 Au 42.84911873 37.67261282 40.32855624 -155.01656067 -156.43386259 -139.18547279 Au 43.60556472 38.49425818 41.03735392 153.97290662 165.29694260 143.27416333 Au 42.20384740 34.85081933 42.03810700 72.06899022 -118.27993233 60.38734606 Au 43.24802608 36.25091938 43.76534421 0.17785005 1.05272926 0.65797387 Au 39.73333753 37.00409575 43.00005349 46.53335719 99.10626647 -55.29527051 Au 41.03695434 38.28719268 43.94632733 10.02466499 9.60281973 6.88261900 Au 34.94292271 39.80099153 40.20999044 -11.17973267 1.54903505 4.91500744 Au 36.26332309 41.49467021 41.17665376 -3.20148962 -1.07078136 3.65123531 Au 37.82350393 42.21827495 39.80335328 -23.81726792 -36.46259342 -43.02906402 Au 38.63834321 43.28337470 40.87827378 28.13611893 41.93358206 38.83173407 Au 37.36102597 39.94186987 42.87644269 46.30898180 46.00720242 -30.23803648 Au 39.23911782 40.86547492 43.69892213 3.29150273 0.00086986 6.12566010 Au 35.06236183 42.74812411 42.77511221 -7.88064212 -2.95362312 -1.50009039 Au 36.48115325 43.96771709 43.78828861 5.94846310 4.94496832 4.07881718 Au 39.68857725 39.62342496 39.94578024 7.18457473 -6.30918139 7.96039926 Au 40.89974943 41.22892384 41.12165250 45.35453231 -101.75069389 -132.29577698 Au 42.34497277 42.78015998 39.71375535 59.35305557 -19.19132005 37.79071093 Au 43.88267273 43.86430419 41.59585655 -1.05867335 -0.81487525 -0.43573944 Au 42.58408063 40.67016232 42.02045641 15.69504012 -7.10576570 2.79871383 Au 43.53876595 41.01639986 43.91426806 3.88257374 1.58830846 7.86852510 Au 40.39757659 42.11536967 42.13716159 -59.89535262 109.83830848 122.40024836 Au 41.08374732 43.77016552 43.57819544 1.35787837 2.45281377 2.05981660