108 Lattice="10.662015313875546 0.0 0.0 0.0 10.662015313875546 0.0 0.0 0.0 10.662015313875546" Properties=species:S:1:pos:R:3:forces:R:3 energy=-305.3289423821395 stress="-0.0047543257387222 0.00026448764367396666 0.0004766410728892772 0.00026448764367396666 -0.004938100512732553 0.0007050335413772605 0.0004766410728892772 0.0007050335413772605 -0.0048885764065246" free_energy=-305.3289423821395 pbc="F F F" Cu 0.00036668 0.00722586 0.01521694 0.26469337 0.31601618 0.27808572 Cu 1.75037766 1.80172207 0.01046120 0.11708085 -0.24812100 -0.19539600 Cu 1.74348497 0.02547434 1.75548498 0.10318384 -0.18726674 0.05054398 Cu 0.01526970 1.74457951 1.81919990 -0.21688938 0.19924907 -0.13281650 Cu 3.57377763 0.00195799 0.02813710 -0.12978459 0.17702381 0.15008300 Cu 5.35405584 1.75590840 0.00232839 -0.10873607 0.06674694 -0.05947145 Cu 5.32998506 0.00701263 1.81033175 0.16784024 -0.19026970 -0.15563817 Cu 3.52152100 1.76352874 1.80697421 0.08378971 -0.04010820 -0.45858408 Cu 7.12574462 0.02573515 0.01882942 -0.11122562 0.01974915 0.13143483 Cu 8.87939271 1.76634591 0.00738677 -0.15474897 0.18667406 0.17512151 Cu 8.91359738 0.00733157 1.78186483 -0.18825849 0.21934538 0.13095693 Cu 7.12176770 1.75143350 1.75170054 0.05025478 0.07187664 0.13384826 Cu 0.04818760 3.55921365 0.01027655 -0.10936567 -0.06857972 0.06843761 Cu 1.73306547 5.36856390 0.01125066 0.23363681 -0.15688046 -0.10912377 Cu 1.74481305 3.52140293 1.74938513 0.13079557 0.20605508 0.16928241 Cu 0.00381766 5.32224639 1.80129428 -0.14429499 0.13154503 -0.05677395 Cu 3.56017131 3.54452795 0.01581571 -0.17078017 -0.02246035 -0.21063668 Cu 5.30528806 5.30886348 0.02559530 0.17713725 0.17567937 -0.24780444 Cu 5.29600382 3.54086690 1.80371861 0.34583747 -0.17862788 -0.35423872 Cu 3.57084925 5.33476249 1.79222144 -0.30893334 0.00913805 -0.30646746 Cu 7.07451740 3.55204292 0.02326898 0.13343410 -0.04725498 -0.11243875 Cu 8.82828692 5.36086581 0.03013034 0.02272605 -0.13335987 0.04457706 Cu 8.88064951 3.55759302 1.81143625 0.06700375 -0.04162836 -0.17766618 Cu 7.08249295 5.34775063 1.78571575 0.19296898 -0.08613142 -0.07416116 Cu 0.02743159 7.13438999 0.03009728 0.06350777 -0.08448443 0.12063358 Cu 1.82506225 8.88074521 0.01736296 -0.02980520 -0.09517697 0.06804875 Cu 1.78167588 7.13488097 1.77132270 -0.00581499 -0.12118706 0.01861957 Cu 0.04064258 8.86486188 1.79760958 0.00888190 0.06608522 -0.07621456 Cu 3.52307452 7.07869060 0.02287173 0.16126005 0.14249851 -0.20928003 Cu 5.31745568 8.91375750 0.02847654 0.00985194 -0.27024229 0.14427158 Cu 5.33082637 7.12902416 1.79311890 0.01219600 0.09904569 -0.17625764 Cu 3.52691916 8.89875914 1.77958543 0.09856134 0.06943971 0.08468243 Cu 7.12158670 7.08711116 0.02424358 -0.20679057 0.17016278 -0.15343570 Cu 8.86893310 8.85830014 0.01772279 -0.26376266 -0.30410297 0.28230952 Cu 8.90296928 7.09177982 1.78163629 0.00377425 0.07657463 0.13047352 Cu 7.10867061 8.87844637 1.75817623 0.07925313 0.03632891 0.11283713 Cu 0.00811544 0.00300829 3.54935364 0.11326607 0.09423011 0.03042191 Cu 1.80655041 1.78971362 3.57352928 -0.36926951 -0.13887857 -0.09419913 Cu 1.76789896 0.02729273 5.30333081 0.16562627 -0.26202810 0.10688838 Cu 0.01854593 1.75322081 5.36336453 -0.16698489 0.18214715 -0.08299195 Cu 3.55554949 0.00079475 3.49288947 -0.18703189 -0.31243980 0.23725709 Cu 5.30411400 1.75611269 3.56258562 0.37262876 -0.07868962 -0.10740668 Cu 5.33162552 0.01335195 5.30201368 -0.05012647 -0.31804723 0.13000232 Cu 3.57459237 1.80081475 5.32452496 -0.24277346 -0.36874725 0.11991106 Cu 7.14202950 0.02179360 3.56510901 -0.06770392 -0.16832649 -0.08946640 Cu 8.86118597 1.80826393 3.57468678 0.25221330 -0.09819553 -0.14562613 Cu 8.89973077 0.04235108 5.32649074 -0.07673004 0.01558410 0.04075651 Cu 7.11311173 1.77906107 5.36741302 0.16759483 -0.09489565 -0.20262743 Cu 0.01230351 3.58206107 3.57533295 -0.25115956 -0.25361461 -0.11041857 Cu 1.81140995 5.33606197 3.56284342 -0.40281359 -0.04525351 -0.36177394 Cu 1.75687920 3.58686796 5.32944812 -0.21149347 -0.38484697 0.16800576 Cu 0.00956338 5.36443381 5.29385460 -0.32943008 -0.06668688 0.14345157 Cu 3.58397498 3.56379629 3.56341933 -0.35820964 -0.14801155 -0.14208482 Cu 5.33059195 5.31316198 3.56560592 0.23458846 0.21790825 -0.05327881 Cu 5.36570665 3.55492165 5.34400885 -0.12314613 -0.05699613 0.08245972 Cu 3.53273598 5.29109884 5.33727937 0.12010437 0.23702092 0.20287294 Cu 7.08045817 3.53642488 3.57363794 0.31065927 -0.04064311 -0.22913141 Cu 8.85960735 5.30416907 3.57357685 0.24036481 0.13851165 -0.08597077 Cu 8.91619734 3.55124513 5.32968646 0.12659414 -0.14056031 0.08571411 Cu 7.13464162 5.30377724 5.38746898 0.10215578 0.36388690 -0.25854384 Cu 0.03139843 7.12821303 3.50843050 -0.28381420 -0.08718227 0.15332877 Cu 1.74688193 8.88930834 3.53254736 0.31937846 0.15486134 0.15201009 Cu 1.77893829 7.07701148 5.29927027 -0.05451952 0.50324892 0.31756593 Cu 0.03287452 8.91821982 5.31880383 0.17726846 -0.27346361 0.09297762 Cu 3.56017620 7.07335148 3.57833378 -0.08725663 0.58176552 -0.23046536 Cu 5.32778191 8.90890279 3.53335162 0.08533364 0.07431857 0.09255723 Cu 5.30558327 7.07842481 5.31590397 0.36290346 0.41124528 0.23503628 Cu 3.55318060 8.89917236 5.35542419 -0.01146869 0.08468930 -0.09357868 Cu 7.11734796 7.09745512 3.57958335 0.06145951 0.23663374 -0.16928862 Cu 8.88829507 8.89086138 3.54650079 -0.18660484 -0.14836270 -0.10349600 Cu 8.89155620 7.13372955 5.31580168 0.18196148 -0.19019152 0.08947774 Cu 7.13272872 8.87804632 5.34525376 -0.19725384 0.14130736 -0.01919643 Cu 0.03242338 0.01153167 7.09864066 0.15943288 0.09571957 0.01043590 Cu 1.81169575 1.75601354 7.13167508 -0.39792882 0.09566575 -0.00670010 Cu 1.77777759 0.00652681 8.89973266 0.06822363 0.13488573 -0.11971682 Cu 0.00188260 1.76960010 8.88272782 0.22184324 0.09452236 -0.18545749 Cu 3.52060795 0.02780681 7.12316949 0.17063584 -0.22007954 -0.11484150 Cu 5.37421369 1.78784748 7.07420004 -0.26878259 -0.20665687 0.49572005 Cu 5.30722860 0.01882383 8.88551963 0.12012508 0.12478629 -0.18390078 Cu 3.56108821 1.76803804 8.88451963 0.03837064 0.19910225 0.14844189 Cu 7.09288126 0.01366938 7.08025725 0.10420031 -0.20835272 0.26378946 Cu 8.85848205 1.75218008 7.09555403 0.13962450 0.21155597 0.27190055 Cu 8.89796929 0.01815429 8.87928362 -0.41020492 0.35011487 -0.35565892 Cu 7.08842571 1.80511793 8.91187109 0.17669698 -0.13418051 -0.05234509 Cu 0.00844531 3.55272211 7.14123908 -0.13054050 -0.06142697 -0.18731255 Cu 1.74461238 5.33727644 7.10127693 0.06227816 0.08086228 0.23003155 Cu 1.77196916 3.58783336 8.88613603 0.01786356 -0.23118375 0.17127181 Cu 0.00245176 5.33012956 8.87946996 0.09635832 0.11098943 -0.06559984 Cu 3.52097910 3.53546325 7.08680698 0.18242748 0.02435759 0.43216097 Cu 5.34458067 5.32377479 7.11706977 0.01850135 0.16266535 0.19336593 Cu 5.36221490 3.57861566 8.87590263 -0.17797217 -0.20515710 0.21066357 Cu 3.56086243 5.30972103 8.88023911 -0.04111078 0.12898546 0.18315379 Cu 7.11283036 3.58428197 7.11723782 0.36860936 -0.31487120 0.28500959 Cu 8.90053197 5.30673199 7.09512660 0.19536900 0.22412587 0.11188682 Cu 8.90925121 3.58749569 8.91435899 -0.23708658 -0.19619205 -0.25894856 Cu 7.11741235 5.32862462 8.90794394 0.04436082 0.12130853 0.06166886 Cu 0.02394197 7.08234363 7.08559991 -0.12119957 0.33551960 0.15515726 Cu 1.82335498 8.88978443 7.10246690 -0.21894473 -0.07163087 0.07471015 Cu 1.79261613 7.10332352 8.88848534 -0.07704546 0.01380424 0.02464942 Cu 0.03100281 8.90193433 8.89750269 0.40395652 -0.42228334 -0.44681972 Cu 3.58624605 7.07682911 7.11130487 -0.32316519 0.27877671 0.07944912 Cu 5.36352319 8.85744122 7.14305486 -0.15702795 0.20275419 -0.28726739 Cu 5.33748296 7.12974990 8.87610783 0.07995451 -0.21968651 0.24984291 Cu 3.56324051 8.85738706 8.89445765 -0.06088718 -0.08017832 -0.15440660 Cu 7.14577766 7.12506795 7.13068199 -0.19056305 -0.21567442 -0.16062344 Cu 8.86830405 8.83065620 7.11438607 0.05602408 0.12030766 -0.14742823 Cu 8.87023596 7.12395001 8.84175153 -0.03029740 -0.20888411 0.05625298 Cu 7.09938956 8.89522735 8.82244863 0.00311154 -0.03902092 0.08847219