1372 Lattice="25.0917337693042 0.0 0.0 0.0 25.0917337693042 0.0 0.0 0.0 25.0917337693042" Properties=species:S:1:pos:R:3:forces:R:3 energy=-4539.7851069493645 stress="-0.0041377542556148995 -0.00015757277126359263 0.0001049196509931001 -0.00015757277126359263 -0.004223708476390535 -5.868360689608381e-05 0.0001049196509931001 -5.868360689608381e-05 -0.004129230805232609" pbc="F F F" Cu 0.00577889 0.00926013 0.02287153 0.64419806 0.64003553 0.61982478 Cu 1.80964988 1.81348605 0.05146206 -0.24153256 -0.07821749 -0.20110531 Cu 1.79174103 0.02856415 1.80757468 -0.16576727 -0.18417026 -0.15193727 Cu 0.02729174 1.79188039 1.81108678 -0.06473969 0.04619377 -0.13013768 Cu 3.58379681 0.00803096 0.00292629 -0.06847475 0.26199290 0.29341893 Cu 5.34940917 1.79966786 0.02695924 0.20394218 -0.15419232 -0.26268142 Cu 5.35901627 0.02757013 1.80181862 0.15912016 -0.25493042 -0.14196801 Cu 3.57833197 1.73989189 1.76160585 -0.02170853 0.40095939 0.28625459 Cu 7.18418842 0.00945059 0.00042583 -0.10146192 0.44579725 0.45929704 Cu 8.94978035 1.79722192 0.05145193 -0.07844999 0.05419656 -0.21642563 Cu 8.98097531 0.02669118 1.75874095 -0.12581642 -0.14266954 0.17974572 Cu 7.13925277 1.82736129 1.80024383 0.21067216 -0.37049338 -0.21369255 Cu 10.72795140 0.00557918 0.00900943 0.15984107 0.42693513 0.35757691 Cu 12.56723079 1.80285000 0.00102218 -0.20089388 -0.17012255 -0.08186579 Cu 12.56730930 0.03062434 1.82071298 -0.26523009 -0.18170135 -0.39966626 Cu 10.76671216 1.82048475 1.76212482 0.06802359 -0.17159306 0.11599507 Cu 14.37234062 0.02342332 0.02289739 -0.05977844 0.36079124 0.35701702 Cu 16.16135069 1.78910687 0.01495618 -0.08640106 -0.05110259 0.01070529 Cu 16.12196192 0.00581845 1.80964517 0.09810165 0.09712249 -0.08074258 Cu 14.30863481 1.81448940 1.78927278 0.38054936 -0.16797565 -0.14820626 Cu 17.92390487 0.02291301 0.02251637 -0.00930370 0.32164269 0.39254468 Cu 19.73553770 1.76569947 0.02230984 -0.16935579 0.14962230 -0.16933067 Cu 19.69473257 0.00948286 1.81611016 0.08294995 -0.17298611 -0.25399862 Cu 17.95342473 1.82093346 1.81184655 -0.24542847 -0.27926352 -0.14014302 Cu 21.51219142 0.02585066 0.01279444 0.10471752 0.38890529 0.53849158 Cu 23.30847316 1.79692243 0.01057245 -0.53341425 -0.06141326 0.51026552 Cu 23.33329304 0.00352315 1.82213895 -0.66325884 0.65528563 -0.05267008 Cu 21.47487712 1.81031568 1.75754592 0.53400346 -0.18358369 0.11597371 Cu 0.00849977 3.60871460 0.00395412 0.45155722 -0.08001206 0.48355282 Cu 1.81283160 5.37309867 0.03239479 -0.16132243 0.10118611 -0.08881083 Cu 1.81177466 3.60981047 1.81812816 -0.17227381 -0.25568816 -0.22072492 Cu 0.03339662 5.38290995 1.81094643 -0.12476037 -0.01649189 -0.20031694 Cu 3.60422603 3.60734041 0.02572104 -0.15075622 -0.17890857 -0.22234370 Cu 5.36427768 5.38665661 0.03072572 -0.04386652 0.07648515 -0.36150968 Cu 5.38965018 3.56790119 1.76224671 -0.15907503 0.00464444 0.33437899 Cu 3.61566130 5.34264877 1.79269877 -0.16954019 0.48916282 0.11211766 Cu 7.16337426 3.63173490 0.00901429 0.10741847 -0.21298232 -0.21575628 Cu 8.98994821 5.40113992 0.01301081 -0.16763718 -0.06008384 -0.05282170 Cu 8.93935548 3.60432891 1.82554659 0.10163834 -0.06200111 -0.30352293 Cu 7.13692174 5.36124078 1.77684323 0.21131991 0.13403982 0.29715573 Cu 10.72134487 3.59738202 0.01815255 0.11505476 -0.06407331 -0.06104381 Cu 12.53393449 5.33585648 0.00128347 -0.12590842 0.08604329 -0.07357257 Cu 12.55863814 3.57112473 1.82228463 -0.29727573 0.16256425 -0.18416471 Cu 10.73363472 5.40348112 1.80638294 0.30092973 -0.29018335 -0.19538309 Cu 14.32493078 3.55777404 0.01499604 0.17483467 0.07767306 -0.14685826 Cu 16.08421407 5.39821817 0.01357334 0.10435080 -0.20668463 -0.14619402 Cu 16.15381840 3.56147568 1.80392716 -0.29713350 0.15182151 -0.08146884 Cu 14.30574853 5.35126897 1.78795170 0.21644186 0.06662955 0.21925025 Cu 17.90009500 3.61816466 0.01593764 0.08135918 -0.16737289 -0.16107221 Cu 19.69877688 5.35028976 0.01006208 0.14340054 0.13303953 0.09474383 Cu 19.68097939 3.57171869 1.82300349 0.21183765 0.26941797 -0.26860087 Cu 17.88974317 5.36566662 1.80714950 0.25638482 0.01178048 -0.13492705 Cu 21.50876484 3.60840212 0.00443561 0.09744234 -0.02343599 0.04839501 Cu 23.32964690 5.39582300 0.01822134 -0.51608253 0.00180248 0.43166608 Cu 23.30100685 3.56178365 1.78154153 -0.01208983 0.09774826 -0.00783266 Cu 21.54048297 5.39250907 1.82475675 -0.07257503 -0.22880938 -0.38217590 Cu 0.00843316 7.19432571 0.01915839 0.40511575 -0.08148758 0.37898753 Cu 1.78399025 8.98581605 0.01521522 -0.04866617 -0.12740143 -0.21084772 Cu 1.78048995 7.19550660 1.80277377 0.17195074 -0.14689115 -0.04955074 Cu 0.02339266 8.99390420 1.77838101 -0.21850762 -0.19641077 0.11572275 Cu 3.55548969 7.20417474 0.00289496 0.05912768 -0.11746289 0.01799344 Cu 5.35159322 8.99324563 0.01312347 0.24788780 -0.16417282 -0.26866948 Cu 5.41030460 7.17611519 1.75483860 -0.31009143 -0.03441955 0.26690991 Cu 3.60301290 8.99583035 1.78056497 -0.19698421 -0.17049084 0.14153787 Cu 7.17596478 7.15177237 0.02200644 0.11879098 0.12383878 -0.19028042 Cu 8.95164656 9.00108080 0.03670142 -0.19924204 -0.28968963 -0.23300258 Cu 8.97016773 7.16157442 1.84515376 -0.31683058 0.12141679 -0.28723188 Cu 7.13953567 8.96526754 1.77307455 0.23574005 -0.08299305 0.17560911 Cu 10.71074144 7.20137147 0.02286826 0.16430893 -0.10413796 -0.21738414 Cu 12.57661661 8.92926614 0.01907397 -0.25793883 0.16305881 -0.23522900 Cu 12.51931649 7.14544702 1.77051928 0.11655357 0.05042699 0.15220642 Cu 10.71655604 8.95948511 1.76988937 0.22119971 0.04326083 0.36598418 Cu 14.29976065 7.13885711 0.01198365 0.15367928 0.09183303 -0.13616973 Cu 16.13134345 8.99467976 0.01058153 -0.03906602 -0.26332207 -0.18892604 Cu 16.13234798 7.14253368 1.76736025 -0.31341369 0.17328732 0.14710082 Cu 14.31725264 8.96250779 1.76948224 0.15023708 -0.25408543 0.13261685 Cu 17.92599323 7.15270487 0.02681543 0.11366742 0.08438898 -0.09609283 Cu 19.74996381 9.00090897 0.04371436 -0.28358662 -0.20510805 -0.15071271 Cu 19.74812997 7.16322114 1.82444619 -0.30580599 -0.08623872 -0.23246485 Cu 17.89702720 8.95585052 1.78602108 0.26558973 -0.09058008 -0.11299626 Cu 21.47933658 7.20403471 0.03883042 0.21234892 -0.35768190 -0.20468739 Cu 23.28295646 8.94367331 0.02695853 -0.23721008 0.07850224 0.27782039 Cu 23.30804259 7.16040019 1.81273836 0.17060439 -0.03130785 -0.13250386 Cu 21.56173802 8.93611186 1.77481857 -0.14736468 0.31165387 0.33922826 Cu 0.00719999 10.75193008 0.03116232 0.23924982 0.13188278 0.21369632 Cu 1.80811737 12.54812548 0.02465535 -0.12916282 0.04300556 -0.13302120 Cu 1.75738932 10.73779927 1.76394183 0.24106410 0.15639091 0.19018528 Cu 0.02381923 12.57834464 1.81115711 -0.09827900 -0.04275428 -0.28951156 Cu 3.59580516 10.72117704 0.02444949 -0.11613663 0.26905664 -0.27664061 Cu 5.38645727 12.55788058 0.00559774 -0.10438203 -0.04552525 -0.26860987 Cu 5.40938963 10.77074959 1.77034219 -0.20314855 -0.09820035 0.17451997 Cu 3.59941355 12.52136834 1.76640883 -0.19528987 0.11657268 0.06527105 Cu 7.19418920 10.78890290 0.02430656 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1.79516370 0.22229680 -0.06669647 0.20115190 Cu 17.93456061 12.51417004 1.76259612 -0.17562627 0.20932551 0.22062974 Cu 21.48774032 10.74703505 0.05333896 0.37373177 0.03495545 -0.13746760 Cu 23.28505071 12.52738699 0.03127251 -0.44661210 0.08788041 0.43248738 Cu 23.32164722 10.76684821 1.82286718 -0.05920854 -0.14998768 -0.17098187 Cu 21.48416514 12.53798659 1.81177512 0.28101229 0.17199382 -0.10558742 Cu 0.02053977 14.38821004 0.00507670 0.31917778 -0.10766785 0.40423905 Cu 1.81835342 16.09518338 0.02208811 -0.21600621 0.27052958 -0.17571771 Cu 1.80338406 14.35702459 1.76728975 -0.01050401 -0.09654965 0.18343015 Cu 0.03197875 16.16571401 1.82028550 -0.22081190 -0.25427916 -0.27166073 Cu 3.60891219 14.36859264 0.01477177 -0.09242882 -0.19777530 -0.20597912 Cu 5.38120769 16.11912585 0.01528214 0.01058650 0.16264406 -0.19585503 Cu 5.34152062 14.31864210 1.79088581 0.32013074 0.09052154 0.15990413 Cu 3.60792279 16.16221332 1.77496155 -0.10614095 -0.09434584 0.24845362 Cu 7.13803830 14.36643794 0.03448466 0.14736005 -0.10269924 -0.11135157 Cu 8.96652315 16.11015528 0.00890867 0.05882829 0.13427506 -0.01939782 Cu 8.98456916 14.36024325 1.76741591 -0.19679209 -0.22636744 0.26759502 Cu 7.14869195 16.15613839 1.81331908 0.13089182 -0.26015065 -0.11279505 Cu 10.75408258 14.31619395 0.02234046 0.13530507 0.11250133 -0.13974962 Cu 12.55202729 16.11457027 0.01652669 -0.01589292 0.05908352 -0.15868438 Cu 12.58053984 14.36513450 1.81890674 -0.34374729 -0.33174201 -0.19118449 Cu 10.77161710 16.10287167 1.83069078 -0.18794772 0.21919517 -0.28329503 Cu 14.34861475 14.34199440 0.02587523 -0.09709453 -0.14343442 -0.30675441 Cu 16.10363948 16.11155430 0.02551649 0.19435896 0.19437496 -0.09322463 Cu 16.10456969 14.36080649 1.82394537 0.32413166 -0.26142852 -0.15075087 Cu 14.31864047 16.09492671 1.77749095 0.16618981 0.56817507 0.11669730 Cu 17.88875516 14.35281720 0.03668249 0.05428791 -0.10036413 -0.12914509 Cu 19.70564768 16.12366042 0.02987239 0.03696171 0.13276636 -0.21548156 Cu 19.69015819 14.30517065 1.76118866 0.11715217 0.15046464 0.29490976 Cu 17.95744290 16.16529625 1.81805896 -0.24272663 -0.17525803 -0.23968308 Cu 21.47369845 14.34280571 0.03296119 0.39160913 -0.05782109 -0.08550816 Cu 23.29096310 16.15035247 0.00348134 -0.40863609 -0.10107883 0.42039197 Cu 23.33196802 14.35853525 1.81250645 -0.17373822 -0.10059469 -0.28076729 Cu 21.47442289 16.14079121 1.76525208 0.16734619 -0.03454777 0.13505837 Cu 0.02039869 17.92337555 0.00345673 0.36174346 -0.08415882 0.36355515 Cu 1.79418809 19.67559707 0.02349077 -0.10978895 0.08993694 -0.21234799 Cu 1.75881646 17.90461893 1.82481261 0.30030691 0.13976830 -0.17142196 Cu 0.02839206 19.71883224 1.79217657 -0.31566814 -0.18353389 -0.09646958 Cu 3.55127128 17.90905836 0.03268823 0.18045744 0.08750611 -0.19785191 Cu 5.39954823 19.74569028 0.00753909 -0.09348467 -0.30161619 -0.06464871 Cu 5.41017467 17.91420389 1.77907808 -0.19819132 0.19016129 0.07800772 Cu 3.57115834 19.71968494 1.76411124 0.06405540 -0.30522099 0.23961342 Cu 7.20238559 17.90551146 0.03365879 -0.11837188 0.07886543 -0.26814651 Cu 8.96897358 19.70178124 0.01132902 0.03407433 0.12127354 -0.05055974 Cu 8.95335439 17.95235917 1.79836454 0.22568544 -0.28014695 -0.09594806 Cu 7.18381032 19.70212196 1.81847492 0.00049464 0.09459162 -0.26981772 Cu 10.78278555 17.89825065 0.02494783 -0.12888496 0.02275118 -0.05482971 Cu 12.53976632 19.72942259 0.04412566 0.06865232 -0.00995823 -0.15045646 Cu 12.53730773 17.89245637 1.82075168 0.12339444 0.08779159 -0.20040335 Cu 10.76501926 19.69825336 1.80960517 -0.21257216 0.11833765 -0.20734391 Cu 14.36444624 17.95355839 0.01520841 -0.34324745 -0.28736655 -0.18278848 Cu 16.10072819 19.69594582 0.02329108 0.15085028 0.25396307 -0.31212949 Cu 16.12181963 17.95571607 1.75662615 0.16307025 -0.36544405 0.25898672 Cu 14.33470797 19.67960843 1.79348506 -0.17492039 0.42379498 0.10323574 Cu 17.95100309 17.92849792 0.01050318 -0.16818090 -0.04652690 -0.20194858 Cu 19.73056105 19.73725787 0.01285772 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1.80329512 0.23176260 -0.21465043 -0.22031679 Cu 7.14082270 21.47544782 0.01355016 0.23113281 0.22048795 -0.01680701 Cu 8.97866838 23.31077100 0.00648552 -0.06453210 -0.44555772 0.31572802 Cu 8.94325925 21.53745453 1.80322908 0.19778542 -0.30280476 -0.28316727 Cu 7.20413064 23.27916227 1.76506413 -0.25088318 0.09415068 0.05671076 Cu 10.73892426 21.50292028 0.00074423 0.05490019 0.14570569 0.06156305 Cu 12.57190182 23.32528144 0.03096453 -0.20779760 -0.40465626 0.37846352 Cu 12.52040030 21.51101719 1.80815755 0.14287192 0.14004509 -0.12854522 Cu 10.72234156 23.28399744 1.80636425 0.22538846 0.10626485 -0.13577966 Cu 14.33330242 21.57367251 0.03210464 -0.04550524 -0.23920023 -0.12253516 Cu 16.11806471 23.32991610 0.01480488 0.06542272 -0.42704351 0.42822607 Cu 16.10155242 21.48324619 1.77246534 0.12800046 0.14980785 0.22162982 Cu 14.31935487 23.30077280 1.80041967 0.11874910 0.13894811 -0.00961933 Cu 17.89958339 21.48442420 0.02431289 0.03617687 0.20933424 -0.09275614 Cu 19.68244444 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16.14489541 7.19133702 23.29956157 -0.12195449 -0.05571361 0.08792187 Cu 14.30243927 8.97436318 23.26489876 0.12355358 -0.05782722 0.08613297 Cu 17.92887331 7.18728156 21.53660082 -0.03595565 -0.23241173 -0.33475304 Cu 19.74830355 8.95000218 21.47897125 -0.16680712 0.20092040 0.21722677 Cu 19.71619347 7.13361559 23.32364258 0.11548848 0.17380383 -0.03958701 Cu 17.94788525 8.92625222 23.26760768 -0.03405789 0.29974500 0.19517740 Cu 21.48181774 7.18632657 21.49834847 0.24080725 -0.13648865 0.30739989 Cu 23.31301011 8.98699493 21.48814059 -0.04093066 -0.20668347 0.19051473 Cu 23.28391718 7.17998838 23.26571539 -0.35655770 0.08216307 -0.35372560 Cu 21.50721068 8.98801250 23.30324873 0.13641078 -0.21474927 -0.01916497 Cu 0.00400157 10.79043140 21.53352561 0.00083080 -0.16546871 -0.06827237 Cu 1.76997484 12.53516627 21.51280763 -0.10848952 0.12821968 0.05012428 Cu 1.82152076 10.76275183 23.26435985 -0.28814930 -0.03517773 0.35654998 Cu 0.00058973 12.56745794 23.32262608 0.45312111 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21.54162390 0.14394686 -0.12431281 -0.26276333 Cu 16.09517657 10.77630563 23.32274934 0.23265181 -0.32597268 -0.00019518 Cu 14.36007888 12.51931521 23.30516231 -0.26099334 0.11646400 0.04936061 Cu 17.89223973 10.72631776 21.49374805 0.23164639 0.19266564 0.18849371 Cu 19.68633281 12.57554647 21.48005741 0.28105629 -0.32254710 0.20645737 Cu 19.74288173 10.73094846 23.27684688 -0.16836139 0.23233250 0.00503345 Cu 17.90684667 12.53190434 23.33193980 0.12511218 -0.03191098 -0.09089330 Cu 21.52706612 10.77422721 21.53421266 -0.10752686 -0.10791270 -0.19426238 Cu 23.26712109 12.57271719 21.54149742 0.23632154 -0.12433870 -0.23896431 Cu 23.31509780 10.74196307 23.26401627 -0.33037762 0.05699759 -0.25447376 Cu 21.53930766 12.58154350 23.27981615 -0.14001391 -0.12741002 0.11161436 Cu 0.03958461 14.34641915 21.52800659 -0.09905718 -0.00228676 -0.02158958 Cu 1.76716856 16.14946351 21.50922005 0.12339274 -0.22430066 0.07345065 Cu 1.82565269 14.33053876 23.28923331 -0.32870068 0.13738468 0.19612053 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