500 Lattice="17.94168126453123 0.0 0.0 0.0 17.94168126453123 0.0 0.0 0.0 17.94168126453123" Properties=species:S:1:pos:R:3:Z:I:1:forces:R:3 energy=-1503.6776213761548 pbc="F F F" Cu -0.00028917 -0.01198519 0.01392524 29 0.37186844 0.43707762 0.38510753 Cu 1.80264136 1.78031008 -0.00824162 29 -0.17619105 0.10646099 0.18292926 Cu 1.77093469 -0.00720718 1.76035635 29 0.03318637 0.14923146 0.13025441 Cu -0.03087667 1.80188658 1.81458760 29 0.15175349 -0.11291046 -0.12024070 Cu 3.56855657 0.00769287 -0.00616259 29 0.05827603 0.27572750 0.22657767 Cu 5.39818972 1.82402094 0.01408990 29 -0.10632339 -0.17518616 -0.11062604 Cu 5.39471407 0.03470688 1.76157082 29 -0.15421236 -0.08989941 0.10736752 Cu 3.59565223 1.79298251 1.76857155 29 -0.12469514 -0.12217742 0.18989151 Cu 7.18616232 0.02520938 0.01225776 29 0.04851470 0.25313153 0.17731327 Cu 8.99966514 1.81906180 -0.03368008 29 -0.12645328 -0.13134191 0.14537921 Cu 8.93675443 0.01772949 1.82407113 29 0.17046409 0.07007852 -0.17630832 Cu 7.17140243 1.82530007 1.76668490 29 0.11138976 -0.27924412 0.07314003 Cu 10.77063333 0.02176091 0.00901762 29 -0.09243436 0.17194560 0.17078295 Cu 12.55997710 1.80677120 0.03578722 29 0.02952022 0.04121459 -0.25423020 Cu 12.53828487 0.03251838 1.75916374 29 0.22532957 -0.18605771 0.13961676 Cu 10.79726620 1.76318530 1.77433146 29 -0.39611781 0.22048541 0.06365379 Cu 14.31280044 0.02547827 -0.03558726 29 0.01076224 0.25426959 0.32110729 Cu 16.14155715 1.77627626 -0.00754327 29 -0.36124359 0.11353146 0.22948947 Cu 16.12754963 0.02366272 1.76650787 29 -0.35474759 0.29434660 0.09374654 Cu 14.32951655 1.81002209 1.76431255 29 0.23527531 -0.22446848 0.09204032 Cu -0.00887924 3.57188487 0.03375784 29 0.25397328 -0.06320337 0.15804043 Cu 1.81303869 5.34157561 -0.02083613 29 -0.02214153 0.06981859 0.21441389 Cu 1.77410060 3.59448255 1.82474447 29 0.08306578 -0.16174076 -0.35365940 Cu -0.00665592 5.35422359 1.77383836 29 0.06400318 0.07326232 0.08391343 Cu 3.61933380 3.54805289 0.03416636 29 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0.28433813 Cu 16.15560569 3.55527530 1.76206696 29 -0.03218893 0.06480458 0.06036298 Cu 14.34539904 5.36121398 1.81409910 29 0.21892657 0.20138170 -0.17528344 Cu 0.01167578 7.17369326 0.03386743 29 0.27375544 0.02346485 0.21234838 Cu 1.81012712 8.99096657 0.02732073 29 -0.06154854 -0.12789206 -0.04041107 Cu 1.78261484 7.18971758 1.80365163 29 -0.07723990 -0.17026574 -0.29182311 Cu -0.02825675 8.99699003 1.80043331 29 0.02068111 -0.12129165 -0.10286206 Cu 3.58520480 7.14743725 0.03347589 29 -0.11092337 0.09732906 -0.07228048 Cu 5.32830200 8.98103761 0.00346362 29 0.27497346 -0.16147564 -0.09770888 Cu 5.40025635 7.19814431 1.80020441 29 -0.19825990 -0.08788198 -0.18985392 Cu 3.59046882 8.95835547 1.80565344 29 -0.15785236 0.08452692 -0.09871346 Cu 7.20185252 7.15828090 -0.02932409 29 -0.16570319 0.20961820 0.05940485 Cu 8.93782919 8.99137371 -0.01764417 29 0.11327023 -0.09873492 0.09472274 Cu 8.99119061 7.15866829 1.79122083 29 -0.16556570 0.29815891 -0.08547286 Cu 7.14258661 8.94868773 1.80038261 29 0.28971190 0.26671926 -0.21209180 Cu 10.73733484 7.15647430 0.02639386 29 0.18265591 0.15729402 -0.14665086 Cu 12.58845967 9.00653847 0.01796099 29 -0.10614450 -0.08745106 -0.16772566 Cu 12.57291326 7.18061666 1.81813119 29 -0.13458790 -0.10730312 -0.30833674 Cu 10.80321408 9.00382867 1.73040523 29 -0.29073515 -0.13582024 0.21265871 Cu 14.33354218 7.21219588 0.01708805 29 0.12399663 -0.14678532 -0.00872683 Cu 16.15155916 8.99986489 -0.02303022 29 -0.35455957 -0.11134916 0.42233497 Cu 16.14989662 7.15248586 1.80323721 29 -0.06576193 0.13225414 -0.17014619 Cu 14.33245272 8.94109761 1.80975581 29 0.38144503 0.32801031 -0.23470063 Cu 0.00681110 10.74896327 0.00837970 29 0.21676869 0.09055746 0.22776011 Cu 1.80783854 12.57026121 0.00719040 29 -0.05628619 -0.13029001 -0.06946897 Cu 1.76531829 10.76906757 1.80131426 29 0.12273358 -0.04286535 -0.17282415 Cu -0.00061612 12.57644569 1.80239120 29 -0.06895556 -0.05246374 -0.19061427 Cu 3.60345557 10.73852969 0.00768889 29 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-0.08458383 0.22822295 Cu 16.16926624 10.79746411 1.77479339 29 -0.18390920 -0.15460714 0.11868764 Cu 14.35732913 12.53403086 1.82039061 29 0.21389104 0.22193741 -0.23013826 Cu 0.03530074 14.36396001 -0.00156463 29 0.14180541 -0.08632448 0.20058887 Cu 1.80819082 16.12324888 0.01598552 29 0.03592754 -0.21607677 0.24668746 Cu 1.77205482 14.32254469 1.75346587 29 0.08783963 0.37795431 0.26086844 Cu -0.02911066 16.13946798 1.78918648 29 0.43441534 -0.37888097 0.14491180 Cu 3.61378605 14.35030093 -0.01774776 29 -0.06973558 0.12370021 0.06207363 Cu 5.40264743 16.18075407 -0.03481212 29 -0.08807422 -0.38083737 0.40237188 Cu 5.39613493 14.37456661 1.79797093 29 -0.07335417 0.12249243 -0.30514077 Cu 3.56033273 16.11828323 1.80496889 29 0.14162328 0.01505201 -0.14606817 Cu 7.20216251 14.38405474 0.03171336 29 -0.04286134 -0.09972871 -0.04802899 Cu 8.95143016 16.15443791 -0.01457192 29 0.13802530 -0.30582033 0.35051792 Cu 9.00372650 14.34113003 1.82866494 29 -0.28203281 0.32093525 -0.42805042 Cu 7.17796902 16.17785930 1.75861023 29 0.06633868 -0.09582197 0.11471455 Cu 10.78206459 14.33498194 -0.00164937 29 -0.05152074 0.20764065 0.07572467 Cu 12.61069782 16.15877832 -0.01183931 29 -0.07840259 -0.36854488 0.38275598 Cu 12.59456876 14.33309838 1.79673969 29 -0.10192122 0.33488980 -0.22113666 Cu 10.75402124 16.17157223 1.81980224 29 0.06845892 -0.21000343 -0.26061031 Cu 14.37390210 14.32910551 -0.03507439 29 -0.13332609 0.05849456 0.19451582 Cu 16.13175681 16.14870977 0.02763000 29 -0.33232141 -0.38373305 0.30586376 Cu 16.14618104 14.33686163 1.77247729 29 -0.15396604 0.10327247 0.06358915 Cu 14.37849068 16.17572781 1.75536140 29 -0.11347827 -0.27563759 0.17994182 Cu -0.00202295 -0.02429628 3.57546481 29 0.33708512 0.31620018 -0.00984438 Cu 1.76982711 1.81286350 3.56468040 29 0.08099568 -0.27340687 0.09878841 Cu 1.80580212 -0.02482234 5.37592154 29 -0.16207247 0.22628648 0.08905865 Cu -0.00933924 1.81745815 5.33578720 29 0.08530494 -0.16763356 0.14238665 Cu 3.53463966 0.02232732 3.61838771 29 0.19468889 -0.00369779 -0.26314562 Cu 5.40000354 1.77059719 3.59635159 29 -0.20105074 -0.09894962 -0.05625418 Cu 5.36102822 -0.03270044 5.41042222 29 0.07279869 0.11774648 -0.13280726 Cu 3.58636574 1.81100655 5.40544871 29 -0.13398470 -0.18877685 -0.21923680 Cu 7.14337997 -0.01109616 3.55450593 29 0.09544924 0.02083573 0.17029466 Cu 8.95272861 1.78684733 3.61386141 29 0.10746166 -0.12067935 -0.25333998 Cu 8.97378614 0.00110617 5.41178514 29 -0.12473258 -0.10726663 -0.19290306 Cu 7.18585156 1.81671324 5.37487681 29 -0.10615968 -0.48258400 0.11979571 Cu 10.79493923 0.02281776 3.58195820 29 -0.19150192 -0.11197028 -0.02588479 Cu 12.53519831 1.80202526 3.58026089 29 0.27819390 -0.09155670 0.07354689 Cu 12.52797814 -0.02849199 5.36604108 29 0.22068031 0.08700415 0.10044154 Cu 10.74553399 1.77130139 5.40305037 29 0.21531459 -0.05655217 -0.13270438 Cu 14.32202345 -0.01198448 3.58776191 29 0.08150214 0.15687417 -0.05603017 Cu 16.13732558 1.78096883 3.60674544 29 -0.05675831 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7.16528712 5.36334092 5.38960403 29 0.08614893 0.19000624 -0.15123658 Cu 10.76737183 3.58052256 3.60974359 29 -0.05334074 -0.04985746 -0.14317940 Cu 12.55078143 5.41504234 3.60756560 29 0.08554041 -0.22082143 -0.10609983 Cu 12.54431770 3.61874148 5.39717419 29 0.27219166 -0.31888266 -0.12840063 Cu 10.76252551 5.41125771 5.40895614 29 0.08474916 -0.21671148 -0.20337961 Cu 14.36910710 3.55951241 3.55920779 29 -0.03201496 0.05880290 0.18258582 Cu 16.14818985 5.38459788 3.56420067 29 0.06273475 -0.07631460 0.10075932 Cu 16.16375463 3.55985934 5.36303747 29 -0.09817458 0.11155471 0.16435790 Cu 14.36434886 5.38297660 5.36810666 29 0.24418279 -0.18609850 0.12962968 Cu 0.02636698 7.18089510 3.55217658 29 -0.20165604 -0.11586887 0.01898210 Cu 1.72616045 8.95825367 3.60361322 29 0.23072790 0.15947641 -0.17031596 Cu 1.79842148 7.14789403 5.35580356 29 -0.21077039 0.22439849 0.14584575 Cu -0.00082255 9.00007941 5.36228087 29 -0.13501375 -0.17090602 0.16087582 Cu 3.55293302 7.21480299 3.59095811 29 0.28493390 -0.23045847 0.00472017 Cu 5.37200745 8.99791028 3.62146747 29 0.02833570 -0.17881980 -0.15795338 Cu 5.39994618 7.17115130 5.40205125 29 -0.18193195 0.05016618 -0.19533873 Cu 3.55586114 8.98533658 5.41296946 29 0.07001020 -0.12920857 -0.10031123 Cu 7.15440814 7.18725009 3.55466616 29 0.24062362 -0.08211967 0.29261687 Cu 8.99018712 8.95396005 3.60463328 29 -0.10879311 0.11906042 -0.35004697 Cu 8.99824073 7.14730938 5.41008189 29 -0.38771727 0.27189183 -0.21572833 Cu 7.15984165 8.99140841 5.36263188 29 0.24450686 -0.10431617 0.18848185 Cu 10.76319189 7.20180557 3.61628988 29 0.03233187 -0.08941008 -0.25341764 Cu 12.53727397 8.94051670 3.58188635 29 0.20588167 0.19195754 -0.08623415 Cu 12.59468170 7.20075167 5.41167433 29 -0.06238165 -0.08395335 -0.20369590 Cu 10.75903053 8.98691165 5.35716631 29 0.12350600 -0.15476702 0.20078816 Cu 14.37483820 7.17010143 3.60749816 29 0.06411314 0.07620160 -0.08654839 Cu 16.13925523 8.94994033 3.55340433 29 0.06626558 0.07294603 0.02653664 Cu 16.11349685 7.20976984 5.41536395 29 0.15022805 -0.11782454 -0.07085255 Cu 14.35436299 8.99936274 5.40754835 29 0.14363090 -0.19052883 -0.19909259 Cu -0.00795803 10.76394519 3.55620408 29 -0.14100801 0.13532956 0.10733591 Cu 1.77286757 12.54326624 3.55622625 29 0.14199238 0.11737426 0.14969554 Cu 1.78351113 10.76375696 5.36209457 29 -0.11741208 0.19780775 0.22229307 Cu 0.00273285 12.56699714 5.40588786 29 -0.01539185 -0.09825262 -0.12303824 Cu 3.57141316 10.73739898 3.60661418 29 -0.12979387 0.23384164 -0.21626032 Cu 5.36117118 12.59149977 3.55937478 29 0.14821513 -0.25181742 0.07979739 Cu 5.34773613 10.76149520 5.36872470 29 0.24342981 0.22636934 0.10397427 Cu 3.60769361 12.59415901 5.40532381 29 -0.24512432 -0.14851867 -0.12280414 Cu 7.20018651 10.79076652 3.59357966 29 -0.23498205 -0.20864142 -0.16913751 Cu 8.93845698 12.54660987 3.57859283 29 0.23836560 0.22158065 0.15680792 Cu 9.00060684 10.74861277 5.37294809 29 -0.12522567 0.15425718 0.12283609 Cu 7.20192002 12.53759502 5.38315792 29 -0.17940392 0.15334878 0.15351365 Cu 10.79596644 10.78118537 3.61477095 29 -0.16363398 -0.08033356 -0.39747723 Cu 12.55140393 12.57035362 3.56606308 29 0.23191456 0.04691464 0.06011023 Cu 12.54571523 10.75315491 5.36687007 29 0.24360749 0.09601627 0.11934322 Cu 10.79843678 12.58877421 5.36650948 29 -0.32014944 -0.17256216 0.07354648 Cu 14.32513866 10.73387458 3.61640484 29 0.37402317 0.20264905 -0.24297953 Cu 16.15448197 12.57933176 3.57013158 29 -0.01499920 -0.09118474 0.09440990 Cu 16.16390831 10.72982827 5.35083720 29 0.05863008 0.21629291 0.05011753 Cu 14.36354086 12.57662993 5.40169877 29 0.06946662 -0.11849643 -0.24449178 Cu 0.02704358 14.31848606 3.59124884 29 -0.03642132 0.23324667 -0.05528526 Cu 1.81418797 16.18028341 3.58498229 29 -0.10011770 -0.25970368 -0.06737269 Cu 1.81273427 14.31762606 5.35040769 29 -0.11697410 0.40099904 0.19110876 Cu -0.00067162 16.12744065 5.34870075 29 0.33346408 -0.28940717 0.03435875 Cu 3.62418093 14.36761460 3.59542052 29 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