500 Lattice="17.464498130308478 0.0 0.0 0.0 17.464498130308478 0.0 0.0 0.0 17.464498130308478" Properties=species:S:1:pos:R:3:forces:R:3 energy=-1999.612105740017 stress="-0.005747655163337321 -0.00018292726070037878 3.301155558026593e-05 -0.00018292726070037878 -0.005780230614019884 7.980703585808126e-05 3.301155558026593e-05 7.980703585808126e-05 -0.005686345872505772" free_energy=-1999.612105740017 pbc="F F F" Ni 0.02713632 0.02146251 0.02367052 0.65037653 0.66764083 0.68481785 Ni 1.71450810 1.73910517 0.01367748 0.23297796 0.11403517 -0.24809143 Ni 1.77092170 0.00336526 1.71264203 -0.18918427 -0.25158576 0.19499753 Ni 0.00914981 1.74330784 1.75361484 -0.33085659 -0.22390255 -0.10148813 Ni 3.45958691 0.02053218 0.00617942 0.17762610 0.41315952 0.39895945 Ni 5.22149353 1.75850690 0.01713661 0.07606699 -0.28203624 -0.39601143 Ni 5.27320420 0.02624075 1.77502945 -0.06678133 -0.58565423 -0.50192998 Ni 3.52093708 1.77251022 1.74874033 -0.41450864 -0.02118525 -0.07366953 Ni 7.03850364 0.01161088 0.00858775 -0.20021042 0.38840969 0.39474429 Ni 8.71448946 1.76697698 0.02790478 0.18063025 -0.35228387 -0.45908038 Ni 8.74331383 0.00850554 1.77431465 -0.23269162 -0.38756666 -0.36725634 Ni 6.96484111 1.74230356 1.73526895 0.20625277 0.06173512 0.31788707 Ni 10.47710623 0.03481790 0.01912195 -0.15660933 0.26986643 0.29679382 Ni 12.21268208 1.72116735 0.01056966 0.13593992 0.30938498 -0.19665305 Ni 12.21290725 0.00419197 1.73351382 0.12526454 -0.34966614 -0.03648045 Ni 10.45132232 1.74656565 1.77712386 0.41022843 0.34925439 -0.35739512 Ni 13.98851646 0.01505310 0.02412924 0.05356147 0.54795196 0.51414457 Ni 15.73532961 1.77309905 0.02903554 -0.57781744 -0.08091932 0.48280080 Ni 15.74861938 0.01552306 1.71159701 -0.62633551 0.57136675 -0.01741748 Ni 13.95035938 1.76465089 1.72348112 0.35860265 -0.10218626 0.10992279 Ni 0.01106766 3.45955726 0.02133611 0.39357647 0.15569035 0.34313726 Ni 1.78093777 5.26574799 0.01798553 -0.38590340 -0.24373126 -0.37657381 Ni 1.72370054 3.50936969 1.77330555 0.33714752 -0.21277431 -0.28164673 Ni 0.02283536 5.25684360 1.72255424 -0.34147915 -0.13175769 0.11596732 Ni 3.49700162 3.51001639 0.00602385 -0.25557031 -0.25455420 -0.18675120 Ni 5.20929086 5.22607981 0.02321608 0.24647703 0.15122437 -0.37202271 Ni 5.27108479 3.50517256 1.76276866 -0.23370909 -0.06655055 0.26192292 Ni 3.50645358 5.25236126 1.74553145 -0.31004599 -0.22348982 0.30238256 Ni 6.98583125 3.45891541 0.00696931 -0.15133911 0.25713402 -0.45011685 Ni 8.71068002 5.23971331 0.02439277 0.09593049 -0.10218042 -0.56927556 Ni 8.70999895 3.47304406 1.73933164 0.18802431 0.38012622 0.37197198 Ni 7.00841434 5.24665440 1.72773814 -0.38963953 -0.08862207 0.33952477 Ni 10.45750539 3.47634325 0.01326258 0.20748670 -0.02695681 -0.20694061 Ni 12.19261107 5.23824959 0.02469566 0.36644702 -0.00161654 -0.35899907 Ni 12.24289865 3.51831972 1.79354798 -0.25729680 -0.36688456 -0.40683995 Ni 10.48214088 5.26291590 1.71153452 -0.23840629 -0.30921243 0.79448670 Ni 14.00009582 3.52104582 0.01779531 -0.30884525 -0.17977510 -0.39007707 Ni 15.73689718 5.21255810 0.00524673 -0.41735220 0.25719559 0.34778291 Ni 15.69524141 3.52443699 1.72838157 0.50208541 -0.29459765 0.27961048 Ni 13.98119630 5.25093112 1.76820383 -0.19113671 0.24732678 -0.20864522 Ni 0.01209828 7.01707960 0.00121272 0.23218206 -0.19550389 0.15406754 Ni 1.77287407 8.69757510 0.03121899 -0.26559291 0.60968690 -0.72624937 Ni 1.71362095 7.02047496 1.71933824 0.42089164 -0.44525408 0.66617302 Ni 0.01523834 8.71665504 1.71393103 -0.42475257 0.39811375 0.25639830 Ni 3.46440561 7.00164302 0.02674635 0.40136482 -0.12112113 -0.58278933 Ni 5.26095422 8.76245779 0.01867534 -0.09630186 -0.25294553 -0.43929338 Ni 5.20286456 7.01135340 1.76231959 0.45666907 -0.16454208 -0.03886677 Ni 3.51243192 8.72972587 1.71547555 -0.21337656 0.27526498 0.78874721 Ni 6.95781506 6.97754357 0.01489546 0.00831386 0.13340180 -0.26015271 Ni 8.70301896 8.74238643 0.02612905 0.12697710 -0.15644909 -0.37777273 Ni 8.72862502 6.96838468 1.74702695 0.15513349 0.26351455 0.17549424 Ni 6.99966930 8.75387288 1.77071419 -0.34534379 -0.36765103 -0.06461012 Ni 10.45102970 6.98749884 0.01333422 0.06103059 0.23153981 -0.52098342 Ni 12.27631756 8.72622085 0.03478093 -0.26923252 0.20172828 -0.64851943 Ni 12.18400374 7.02926345 1.73130801 0.42746922 -0.35165622 0.54198554 Ni 10.48531654 8.76468010 1.72975925 -0.24863693 -0.30178593 0.24134296 Ni 13.97580406 6.99602217 0.03012143 0.10530976 -0.34861101 -0.43730734 Ni 15.72913550 8.70355799 0.01335496 -0.40462504 0.19793324 0.34784455 Ni 15.70586834 6.98698616 1.73659721 0.47922154 -0.08051987 0.07264588 Ni 13.99437985 8.72524676 1.74073436 -0.14645020 0.13306558 0.26908790 Ni 0.00475421 10.50455110 0.00264373 0.31418063 -0.29878139 0.25843955 Ni 1.72855520 12.19032648 0.01859956 0.24101511 0.42484311 -0.40555825 Ni 1.74099821 10.47969962 1.72658520 0.24865065 -0.24461291 0.41936096 Ni 0.01147362 12.20719251 1.71615469 -0.44041332 0.12809806 0.22932638 Ni 3.51566323 10.50620289 0.01259816 -0.26178801 -0.11264438 -0.40777815 Ni 5.21008228 12.25962118 0.03266037 0.30905549 -0.10094950 -0.51692242 Ni 5.22509382 10.49674702 1.73010316 0.20296254 -0.13376680 0.51469834 Ni 3.50162520 12.24270088 1.77717633 -0.15085835 -0.09975553 -0.23576208 Ni 6.98956530 10.45734879 0.02554437 -0.06145176 0.47765707 -0.35304299 Ni 8.73791308 12.21648933 0.01658726 -0.14694153 0.17304373 -0.20222120 Ni 8.70269785 10.47041439 1.78074511 0.22646304 0.24003904 -0.20685330 Ni 6.96044628 12.25986622 1.77374592 0.23794186 -0.36405472 -0.11616691 Ni 10.46135915 10.47380050 0.01162593 0.07844435 0.03691885 -0.26101245 Ni 12.20219453 12.22324031 0.01206753 0.09679336 0.13637241 -0.24788916 Ni 12.23572388 10.46852331 1.73908172 -0.15608823 0.10101592 0.22563259 Ni 10.45302964 12.23439559 1.77824310 0.29181363 0.02596563 -0.09763891 Ni 13.99487012 10.50873618 0.02135157 0.15318344 -0.22974164 -0.38879151 Ni 15.72416605 12.23275753 0.00664245 -0.36211945 -0.00171839 0.45027031 Ni 15.73625753 10.46249898 1.77531887 0.21480880 0.16782863 -0.28033577 Ni 13.94939315 12.21166910 1.72073866 0.29797971 0.25952022 0.25282113 Ni 0.01991061 13.95233714 0.00386132 0.47685365 0.07755651 0.51670203 Ni 1.71487419 15.70048716 0.00881526 0.11191143 -0.53883826 0.48245843 Ni 1.72643731 13.96501469 1.76715541 0.15020206 0.19607581 -0.34818317 Ni 0.02780493 15.73167205 1.71443953 0.46830751 -0.63572967 0.13616193 Ni 3.49145677 13.98087086 0.02485092 -0.26545796 0.10702299 -0.29307024 Ni 5.26604122 15.71982078 0.00991132 -0.23910798 -0.28341223 0.23639455 Ni 5.25376590 13.97776627 1.74120000 -0.23505943 0.13271992 0.19177441 Ni 3.49198140 15.73499016 1.71712297 -0.08392566 0.11990587 0.13798553 Ni 6.96352896 14.00399724 0.00876789 0.24756529 -0.19750177 -0.38907082 Ni 8.74946109 15.69719514 0.03303385 -0.12244362 -0.29381637 0.17530627 Ni 8.70454734 13.96056064 1.75678641 0.30511917 0.07871631 -0.00924948 Ni 6.96401661 15.73672219 1.72114134 0.12744431 0.34693589 0.16204936 Ni 10.50341207 13.98185370 0.00580335 -0.21223437 -0.09202147 -0.14464037 Ni 12.21084724 15.69518072 0.00563116 0.19013762 -0.27746214 0.33449955 Ni 12.24531357 13.99388535 1.76338861 -0.13966036 -0.06847323 -0.18047351 Ni 10.46032845 15.73951855 1.71294063 0.13456306 0.07770804 0.29561694 Ni 13.99943245 13.98651516 0.02659407 -0.10530774 0.09302541 -0.45340784 Ni 15.74227969 15.73638729 0.00782566 -0.86125966 -0.85009244 0.84416668 Ni 15.68965005 13.97444998 1.71975910 0.29799232 0.21985202 0.16301445 Ni 13.97881047 15.74431838 1.72796887 0.14644071 0.12799404 0.13642407 Ni 0.02686534 0.01473506 3.50210863 0.25660368 0.15544663 -0.29500913 Ni 1.74686475 1.71707743 3.48788973 0.30416856 0.09843416 -0.09838603 Ni 1.71664581 0.02205509 5.25074174 0.35982327 -0.38242357 0.01027609 Ni 0.00796714 1.71378110 5.21029758 -0.37413365 0.21092350 0.36384327 Ni 3.52709707 0.00777321 3.46790652 -0.46278102 -0.37387935 0.10416064 Ni 5.23800407 1.71164601 3.47420058 0.23227654 0.74203735 0.35490834 Ni 5.20670974 0.00543656 5.24812855 0.30481255 -0.34188365 0.04528511 Ni 3.51371739 1.75676257 5.23911748 -0.28623506 -0.12095656 -0.02784577 Ni 7.03206164 0.02984147 3.53410664 -0.26640733 -0.44943382 -0.21916436 Ni 8.74502585 1.77394651 3.46352828 -0.23846074 0.19653396 0.37674568 Ni 8.76558164 0.02282454 5.21612869 -0.20419788 -0.47706339 0.13132115 Ni 7.00986389 1.75118744 5.23614436 -0.05967015 0.22743660 0.08641882 Ni 10.45144772 0.02301611 3.46066230 0.28361892 -0.53033073 0.19620637 Ni 12.21317212 1.73903350 3.46415495 0.21300384 0.28342052 0.17392238 Ni 12.24228264 0.01463812 5.18037488 0.04103020 -0.30985849 0.10699259 Ni 10.47038494 1.72095127 5.26167670 0.16499473 0.55276487 -0.46867279 Ni 13.99353928 0.02007731 3.44014218 0.10556499 -0.28498583 0.10727974 Ni 15.73978784 1.69190820 3.48192910 0.14214753 0.25429521 -0.23027564 Ni 15.72728876 0.02323394 5.26932091 -0.44039238 0.25329963 -0.14834810 Ni 13.99953243 1.76552913 5.24421289 -0.38293405 -0.32063909 -0.43085284 Ni 0.02518982 3.43879224 3.50536699 -0.38827849 0.34191658 -0.11171166 Ni 1.77397956 5.22486108 3.50320180 -0.25493913 0.21456471 -0.26300744 Ni 1.77941106 3.49633271 5.24349885 -0.30290998 -0.19377228 0.10894489 Ni 0.01758758 5.20551626 5.22534778 -0.18295997 0.18091552 0.16428699 Ni 3.45852842 3.46943046 3.51183409 0.55774074 0.17221574 -0.24267813 Ni 5.23311678 5.26291248 3.47099476 0.08932399 -0.33229356 0.20002260 Ni 5.25850329 3.48679318 5.25938863 -0.21787296 0.07807386 -0.34531032 Ni 3.48929282 5.23604860 5.25068009 0.18937901 -0.19123843 -0.06711744 Ni 7.00480852 3.51753053 3.51809997 -0.24235443 -0.26926587 -0.19447637 Ni 8.70315930 5.25050097 3.51364138 0.39167229 -0.14555600 -0.30171493 Ni 8.75045128 3.51208885 5.26157342 -0.27528420 -0.26458653 -0.11430762 Ni 6.95418833 5.22745039 5.26246136 0.18220491 0.24552221 -0.06510767 Ni 10.45854915 3.50538745 3.52283989 0.11147709 0.05822799 -0.28234505 Ni 12.23767028 5.22314242 3.46364706 -0.19866436 0.51540134 0.36576214 Ni 12.24407424 3.45962134 5.21303604 -0.22283096 0.30239832 0.20000930 Ni 10.47315187 5.25395440 5.24813329 0.46000869 -0.05036939 -0.18134281 Ni 13.99948173 3.51661724 3.49422700 -0.28544024 -0.46933234 -0.13904464 Ni 15.69663214 5.25863891 3.52532876 0.44471001 -0.07075150 -0.32030032 Ni 15.68672501 3.47850475 5.19413450 0.62613501 0.08336041 0.21401129 Ni 13.94016775 5.23830477 5.26602729 -0.24028221 0.01855775 -0.26356051 Ni 0.00125066 6.99824402 3.48073838 -0.21634729 -0.14971786 0.03329303 Ni 1.77570038 8.71279399 3.51889859 -0.12428616 0.33156781 -0.62584378 Ni 1.76088212 6.99119828 5.21327415 -0.08238280 -0.22718334 0.36474368 Ni 0.01461268 8.71079538 5.26021999 -0.35967618 0.18803341 -0.15294613 Ni 3.47646649 6.95583250 3.49568024 0.05785604 0.32756142 -0.19932361 Ni 5.26216891 8.70978078 3.50426201 -0.29564993 0.17503565 -0.09095163 Ni 5.20779226 6.96092080 5.24425811 0.35810591 0.30054432 -0.05115622 Ni 3.47090467 8.74077055 5.21072826 0.45598933 -0.30353570 0.26631106 Ni 7.00132947 6.98336893 3.46706699 -0.32469884 -0.17231012 0.23399324 Ni 8.71114812 8.70221991 3.47689168 0.39191864 0.17205793 0.22760516 Ni 8.74205392 6.95271296 5.22686232 -0.20600207 0.25109994 0.25516426 Ni 7.01575030 8.69921318 5.22708594 -0.32560268 0.02625671 0.11088162 Ni 10.47937658 7.01676061 3.52311824 0.02565056 -0.37388443 -0.37432879 Ni 12.19276316 8.73657128 3.52230795 0.34114584 -0.08863065 -0.46388188 Ni 12.24830166 7.00355479 5.24663497 -0.07058282 -0.27634346 -0.12682555 Ni 10.48284674 8.72540173 5.26486709 -0.29506603 0.21498291 -0.16588878 Ni 13.98690591 7.01745874 3.50111720 -0.53043110 -0.20644440 -0.23807888 Ni 15.71728473 8.75091770 3.51421294 0.38571260 -0.20716088 -0.25822131 Ni 15.71220506 6.96540947 5.20468037 0.34377403 0.33756401 0.25710264 Ni 13.96265514 8.73945190 5.22787375 0.15472735 0.01945524 0.25487505 Ni 0.02576391 10.48716180 3.51569428 -0.16864164 -0.09508166 -0.13883229 Ni 1.77818790 12.23476151 3.46459838 -0.21892377 -0.17297488 0.36820197 Ni 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