4000 Lattice="35.941136832145276 0.0 0.0 0.0 35.941136832145276 0.0 0.0 0.0 35.941136832145276" Properties=species:S:1:pos:R:3:forces:R:3 energy=-13504.963024699227 stress="-86.9955712488122 2.4741924182348853 3.404529919881483 2.4741924182348853 -88.2094308347904 0.9293365586639197 3.404529919881483 0.9293365586639197 -85.57815690769664" pbc="F F F" Cu 0.00690150 0.02442106 -0.02784748 0.65297835 0.61968710 0.70373018 Cu 1.80226069 1.78659543 0.03531261 -0.27749591 -0.17607541 -0.06389826 Cu 1.79158975 -0.00963240 1.82021568 -0.07831122 0.05660784 -0.12871236 Cu 0.00932012 1.78106441 1.80094978 0.10152111 0.03591335 -0.12246409 Cu 3.60417416 -0.03517762 0.03555104 -0.06737874 0.43881166 0.45686315 Cu 5.34905504 1.77448497 0.05218315 0.23287991 -0.16386446 -0.10914585 Cu 5.42301567 -0.03083060 1.82891756 -0.21784239 0.05362184 -0.30749625 Cu 3.56072988 1.80211115 1.77630718 0.12001457 -0.33162863 0.32828738 Cu 7.19466965 -0.02451505 -0.00582859 -0.00087798 0.57531578 0.53990188 Cu 9.01242827 1.79508427 -0.01620269 -0.15684693 -0.12548618 0.11657394 Cu 8.99148117 0.01958436 1.79621264 -0.07259311 -0.00025263 -0.12679644 Cu 7.16582335 1.79675495 1.80953951 0.32309648 -0.17424108 -0.34228720 Cu 10.76809909 -0.02452877 0.01764323 0.10743828 0.56137857 0.45124708 Cu 12.61353238 1.82397486 -0.01163334 -0.18438204 -0.34012891 0.09720727 Cu 12.56329821 0.01249790 1.80962568 0.03817949 0.12437183 -0.16795731 Cu 10.77352180 1.80585514 1.82289726 0.22524966 -0.25140454 -0.29067674 Cu 14.34882327 -0.02943818 -0.03280545 0.03792693 0.58016517 0.61100475 Cu 16.19466195 1.76367078 -0.02261572 -0.16003450 0.05755758 0.18355259 Cu 16.14254804 0.04772677 1.82035397 0.11502831 -0.08804429 -0.30783742 Cu 14.35627372 1.81506225 1.78532598 0.05016083 -0.23553401 -0.00878366 Cu 17.97800115 0.03234946 -0.01410028 0.02658247 0.34075441 0.50257720 Cu 19.80553387 1.76158064 -0.03584866 -0.06466957 0.05270875 0.30684312 Cu 19.75753954 -0.02287586 1.83283554 0.21597690 0.04370731 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0.55445908 0.53463698 Cu 34.16051528 1.82986077 0.03134357 -0.51711437 -0.22268834 0.41842602 Cu 34.12302558 -0.03139198 1.81114106 -0.57345499 0.65261884 -0.02653454 Cu 32.34608406 1.76222514 1.79765874 0.07689981 0.09912078 -0.10271561 Cu 0.00480469 3.60570968 -0.03243028 0.50184586 -0.10001006 0.56481830 Cu 1.80757020 5.36237680 -0.01688799 -0.14241868 0.16072767 0.12290056 Cu 1.80445760 3.61781066 1.80433899 -0.28743595 -0.18093837 -0.11166346 Cu 0.02633314 5.38342389 1.79807473 0.00838012 0.10902041 -0.22274714 Cu 3.56339385 3.52926356 -0.00102469 0.17956510 0.31070496 -0.08987631 Cu 5.41940556 5.39475476 -0.02355224 -0.16131907 -0.13126976 0.06793331 Cu 5.39710726 3.56123382 1.82187283 -0.14691593 0.32281868 -0.25677194 Cu 3.62148818 5.35970659 1.76681096 -0.14782075 0.09914838 0.10056251 Cu 7.17754157 3.60167363 0.03571621 0.01266724 -0.17656964 -0.06872561 Cu 8.97251448 5.36623612 -0.01848611 0.07731078 0.11956308 0.08599242 Cu 8.99143556 3.56017415 1.80071328 -0.15286670 0.08596369 -0.10620082 Cu 7.20197490 5.41290402 1.79969091 -0.11477569 -0.21425413 -0.05842086 Cu 10.81502246 3.56396034 0.03046844 -0.14518297 0.11822574 -0.15397904 Cu 12.60009244 5.37379495 -0.02571514 -0.11963029 0.19085569 0.15849163 Cu 12.56706995 3.62264534 1.79218690 0.04415797 -0.19951045 0.05065005 Cu 10.73552330 5.36817064 1.81375000 0.23287396 0.18346837 -0.39569226 Cu 14.37563780 3.59060631 0.03510196 0.17702881 0.05451082 -0.21648548 Cu 16.21683933 5.42144002 0.00554013 -0.10176399 -0.22988909 -0.03806290 Cu 16.15743639 3.61281533 1.79876397 0.30918877 -0.24944922 -0.18241077 Cu 14.37722797 5.35952879 1.81838649 0.00218287 0.34017901 -0.25524764 Cu 17.99863918 3.56102655 -0.00050875 -0.06184804 -0.00450748 0.04187749 Cu 19.81942554 5.37648902 -0.03044585 -0.22091340 0.08320552 0.10075482 Cu 19.76039207 3.61991104 1.80111898 0.10687713 -0.30100802 -0.19041388 Cu 18.00181456 5.37146334 1.79303942 -0.07434957 0.17629126 -0.09458262 Cu 21.57750254 3.58231917 -0.01245760 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1.77105569 -0.14555632 0.18315768 0.23322745 Cu 32.33050729 5.35617651 1.82516312 0.18212954 0.20725718 -0.35204207 Cu -0.01471152 7.16996219 -0.01298569 0.62077310 0.01860760 0.58878370 Cu 1.79421656 9.00152992 0.00610776 -0.21981113 -0.17004825 -0.11263921 Cu 1.82352011 7.22366546 1.82636602 -0.14703601 -0.28995017 -0.21997974 Cu 0.02967387 8.99637871 1.79984948 -0.13835192 -0.05948213 -0.14941405 Cu 3.57551707 7.17838998 0.01963113 0.06401089 0.05902456 -0.07159500 Cu 5.42036447 8.98513702 0.00742026 -0.34594772 -0.00337929 -0.09539495 Cu 5.39529110 7.16379668 1.78461998 -0.14125984 0.21036810 0.15230738 Cu 3.58502398 9.01930878 1.76779310 0.14566239 -0.25905878 0.25276583 Cu 7.15698589 7.22284752 0.03490909 0.30509769 -0.15004451 -0.21442034 Cu 9.02000739 8.98809430 -0.00250432 -0.11884983 -0.05706152 0.08283217 Cu 8.95117263 7.15966139 1.83053722 0.25442186 0.21457194 -0.37953621 Cu 7.16892865 9.00195031 1.78252199 0.12998882 -0.17435304 0.18134939 Cu 10.78872879 7.21913183 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28.77212329 16.14896664 30.54809133 -0.17233561 0.26515291 0.16761133 Cu 32.32864394 14.39755337 28.72734047 0.05707039 0.15202577 0.16462104 Cu 34.14290211 16.21179631 28.77128642 -0.10182295 -0.05510289 -0.06223076 Cu 34.13479951 14.38924832 30.52127494 -0.00335965 0.09121139 0.08551344 Cu 32.31995768 16.20155454 30.55793980 0.39356467 -0.19725231 -0.17133737 Cu -0.00977737 17.95049272 28.76078787 0.11887480 0.10060684 -0.05653301 Cu 1.80013080 19.79728342 28.77339683 -0.19289165 -0.31795177 -0.12650832 Cu 1.77608415 17.99308205 30.57363466 0.12190138 -0.15489732 -0.22942966 Cu -0.02136934 19.74622045 30.55584030 -0.01862676 0.22123257 -0.05269900 Cu 3.59838215 17.98482987 28.72410880 0.00736533 0.02322841 0.19650321 Cu 5.42166971 19.79419891 28.76558780 -0.13196635 -0.16041788 -0.10625997 Cu 5.41583213 17.99234846 30.51546170 -0.10872350 0.18962121 0.21381972 Cu 3.56182438 19.75309595 30.57509974 0.21114934 0.14564211 -0.16253794 Cu 7.16801893 17.98726533 28.76678399 0.26036437 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17.95136198 30.51899303 -0.11980684 0.02749910 0.23062540 Cu 17.94188762 19.77564007 30.57925961 0.20810127 -0.06660249 -0.25795008 Cu 21.57701560 17.95775273 28.74766699 -0.16125983 0.06966639 -0.11964860 Cu 23.36774389 19.75080930 28.78562009 0.04203172 0.19914006 -0.41962625 Cu 23.34196000 17.98447435 30.51742281 0.24869237 -0.23454638 0.29460514 Cu 21.59935442 19.74624559 30.52330891 -0.50677136 0.15103180 0.16460407 Cu 25.15430562 18.00207484 28.77659171 -0.01364778 -0.24367589 -0.30712244 Cu 26.96944414 19.74362506 28.77107191 0.11643700 0.08697963 -0.10157093 Cu 26.94243890 18.00125628 30.58745204 0.24260131 -0.26475119 -0.22521497 Cu 25.19186545 19.73575586 30.57095783 -0.29599517 0.31801872 -0.02040415 Cu 28.76875545 17.96656966 28.75528983 -0.11535214 0.14204865 -0.04025633 Cu 30.54573823 19.78708844 28.72146638 -0.08241573 -0.04614407 0.09369666 Cu 30.56903993 17.97889666 30.53899641 -0.25143198 0.08626841 0.08794426 Cu 28.79288395 19.76998210 30.57289143 -0.15381676 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28.77421354 -0.16970364 -0.25166930 -0.20847453 Cu 8.97792138 21.59994944 30.52031770 0.12331659 -0.16996082 0.15491110 Cu 7.15822319 23.37855188 30.58365646 0.22307278 -0.10885549 -0.05393104 Cu 10.81484936 21.59584445 28.72867353 -0.25810791 -0.38154685 0.15185468 Cu 12.54754370 23.35277364 28.71904742 0.46504590 0.16956898 0.14432500 Cu 12.58459030 21.59379149 30.55597177 0.19134592 -0.21317106 -0.25647037 Cu 10.77743880 23.35914184 30.52405973 0.00581785 0.08935419 0.15285834 Cu 14.40212755 21.53697557 28.73782503 -0.31718793 0.24437321 0.28141927 Cu 16.20515200 23.34305540 28.72941019 -0.21243252 0.23702262 0.32214890 Cu 16.15928162 21.53267542 30.57312500 0.25666027 0.28108439 -0.27154412 Cu 14.40576706 23.34888853 30.55268883 -0.14009825 0.29014658 -0.20831930 Cu 17.99602221 21.58480631 28.72229014 -0.20507265 -0.35764477 0.28512702 Cu 19.76887618 23.34061862 28.70865913 -0.07715486 0.08891511 0.23240938 Cu 19.73444751 21.59706299 30.55827586 0.15484470 -0.31756610 0.10996013 Cu 17.99475090 23.37843828 30.53979182 -0.21329985 -0.13595274 -0.02406817 Cu 21.56192995 21.57988728 28.77440715 -0.09131027 -0.24993013 -0.32976430 Cu 23.33092039 23.35400075 28.72148713 0.23429072 -0.14662636 0.24285609 Cu 23.35132074 21.54319931 30.53049667 0.32744207 0.25437016 0.21311622 Cu 21.54604180 23.33133925 30.53468787 0.08946477 0.06459266 0.27965292 Cu 25.17347924 21.54664703 28.78400094 -0.23479853 0.07533834 -0.24345170 Cu 26.97688352 23.36298269 28.74651977 -0.10706456 0.10344724 0.03925942 Cu 26.93490107 21.56921328 30.53802770 0.22062709 -0.04796152 0.14158444 Cu 25.18300783 23.39220325 30.52494861 -0.34921843 -0.36227668 0.07138031 Cu 28.73998816 21.59826957 28.78055606 0.08466865 -0.28790933 -0.21160737 Cu 30.57009125 23.37932166 28.71931428 -0.13760599 -0.17576112 0.30706317 Cu 30.56389018 21.58471721 30.51855772 0.05991789 -0.03847063 0.22936045 Cu 28.78184551 23.36566690 30.52525081 -0.13433191 0.05743567 0.19473917 Cu 32.36275865 21.58980288 28.75777680 0.07347489 -0.15190144 0.07872387 Cu 34.17998061 23.42919660 28.74537031 -0.03445902 -0.14166319 0.08774901 Cu 34.17998239 21.53278816 30.57872832 -0.19954795 0.04676338 -0.07933317 Cu 32.38318903 23.37394049 30.51535485 -0.06821284 -0.11180990 0.15765063 Cu 0.03159417 25.14771350 28.78177742 -0.10891938 0.10634146 -0.13855739 Cu 1.81237876 26.95319560 28.73899120 -0.09853299 0.12009727 0.05129732 Cu 1.79068095 25.13391869 30.57830769 0.06361574 0.09582680 -0.22701475 Cu 0.03193787 26.98797246 30.55081125 -0.14695138 -0.18104387 -0.16041338 Cu 3.60121709 25.12549032 28.74864294 -0.17364626 0.31707825 0.04416230 Cu 5.41676048 26.92824757 28.72480123 -0.18364287 0.15450495 0.26797301 Cu 5.42246488 25.19168457 30.54822988 -0.27160041 -0.07074350 0.24041212 Cu 3.57015378 26.97052465 30.57051517 0.15092494 -0.06863311 -0.27620989 Cu 7.20132322 25.10990463 28.78103739 -0.11606338 0.26023289 -0.31282404 Cu 8.96517585 26.93185084 28.79792882 0.27917920 0.24290525 -0.38638009 Cu 8.99089751 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