256 Lattice="13.928069318513304 0.0 0.0 0.0 13.928069318513304 0.0 0.0 0.0 13.928069318513304" Properties=species:S:1:pos:R:3:forces:R:3 energy=-992.4702190703141 stress="-0.0121893697865821 0.0016563682929162764 -0.0005013314445159849 0.0016563682929162764 -0.012071022816442388 -0.00039450179629169877 -0.0005013314445159849 -0.00039450179629169877 -0.012307166846428085" free_energy=-992.4702190703141 pbc="F F F" Ni 0.00069421 0.01943203 0.01000462 0.49226618 0.39198432 0.45411381 Ni 1.77116943 1.74171602 0.01433068 -0.38369115 0.44869665 -0.21994183 Ni 1.76439672 0.02433534 1.75177405 -0.22914309 -0.39990438 -0.12189834 Ni 0.03307541 1.74069011 1.76570849 -0.36657920 0.20555934 -0.26699229 Ni 3.46009127 0.03143760 0.02183679 0.20230678 -0.31716162 -0.24427200 Ni 5.24502929 1.74227685 0.02653749 -0.36319065 0.58888936 -0.51666303 Ni 5.25188588 0.01748540 1.70823857 -0.28950830 -0.42805869 0.53143981 Ni 3.50449901 1.74664236 1.71320913 -0.27710961 0.39427489 0.55705849 Ni 6.96578614 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6.95631139 0.02528909 0.32108843 0.19643959 -0.18930391 Ni 5.23647190 8.70679046 0.01869546 -0.45593311 -0.29463593 -0.29319040 Ni 5.25372100 6.94956472 1.76456370 -0.88868600 0.30858985 -0.43990855 Ni 3.48908327 8.72743409 1.75166074 -0.30084681 -0.43254451 -0.24136717 Ni 6.96690896 6.97972440 0.02218257 0.18435206 -0.05528745 -0.33269649 Ni 8.70594515 8.70571814 0.01820742 0.09161869 0.13492684 -0.22567121 Ni 8.71412830 6.97730663 1.76359612 0.05900902 -0.34240118 -0.25739963 Ni 6.95212919 8.69126175 1.77035385 0.20208820 0.41406521 -0.39772440 Ni 10.44689488 6.97501321 0.02623406 -0.10511056 -0.18196775 -0.45850827 Ni 12.20935810 8.69744365 0.02342534 -0.01375926 0.30733613 -0.20211511 Ni 12.18796858 6.99229855 1.72626558 0.37091459 -0.44952465 0.43338377 Ni 10.45478307 8.67476476 1.71326836 -0.16253211 0.62397260 0.57749162 Ni 0.03024322 10.46288565 0.01667099 -0.41241457 -0.41599149 -0.09242839 Ni 1.72789576 12.15325337 0.00836935 0.36821885 0.40295141 -0.13066368 Ni 1.74553860 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0.01955839 0.00791075 3.47079647 -0.05631952 -0.18900872 -0.08894764 Ni 1.73712801 1.72207798 3.47917512 0.18592836 0.58117127 -0.23807421 Ni 1.77492951 0.01401635 5.20022879 -0.22103477 -0.37956361 0.33300836 Ni 0.02674132 1.70898089 5.23514569 -0.22350218 0.41095720 -0.06744483 Ni 3.45311770 0.01846859 3.46138860 0.59879717 -0.29272689 0.01616672 Ni 5.20431198 1.72063178 3.45649722 0.09848486 0.30456390 0.13618435 Ni 5.22421047 0.03367930 5.25630927 -0.19976374 -0.14855414 -0.28132045 Ni 3.44973530 1.77566616 5.20341699 0.38808723 -0.56113861 0.15117148 Ni 6.93796264 0.01608086 3.50441632 0.21917168 -0.26063403 -0.40389144 Ni 8.70417718 1.75331878 3.47447715 0.23375740 -0.21292677 -0.22313863 Ni 8.67858651 0.00786405 5.24150436 0.27803213 -0.23401047 -0.29947618 Ni 6.99279032 1.74497028 5.19207929 -0.37461005 0.08145703 0.46836146 Ni 10.44600943 0.03193862 3.50938214 -0.29959884 -0.22850820 -0.57077693 Ni 12.18502306 1.76247223 3.48895300 -0.03958294 0.32554121 -0.29689867 Ni 12.16264352 0.03265037 5.19233323 0.35330533 -0.18025921 0.33117974 Ni 10.43752874 1.71986805 5.25666472 0.02595300 0.61456657 -0.59094319 Ni 0.02319207 3.48799553 3.46173646 -0.36162517 -0.31784058 0.34046747 Ni 1.71566934 5.24901426 3.46151789 0.81441926 -0.67119350 0.23386436 Ni 1.74072192 3.46696009 5.20223703 -0.28704111 0.21705108 0.20645803 Ni 0.01419572 5.22019492 5.21152592 -0.24338441 -0.39712530 0.26610699 Ni 3.48027158 3.46666971 3.50600811 -0.08600233 0.23829746 -0.66599186 Ni 5.24875515 5.21412540 3.45466319 -0.37105764 0.03553851 0.58014542 Ni 5.21728210 3.45220019 5.24868615 0.18144632 0.13751629 -0.39673761 Ni 3.51316793 5.18948216 5.24992940 -0.43602968 0.19500017 -0.39893366 Ni 6.95823787 3.46222648 3.50571213 0.03076811 0.32545950 -0.21550325 Ni 8.72902138 5.23096984 3.45286453 -0.35857914 0.17257413 0.42937821 Ni 8.73978123 3.45051421 5.20238612 -0.27445982 0.56781524 0.28594978 Ni 6.94214427 5.25541138 5.24745505 0.27180994 -0.31111175 -0.43135225 Ni 10.43330019 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-0.42823187 Ni 8.73552099 3.47621356 12.16497900 -0.30721726 -0.16853115 0.27950451 Ni 6.95569280 5.23395830 12.15492946 0.28882743 0.09775586 0.40412676 Ni 10.47901213 3.49819938 10.41368550 -0.37611224 -0.47012422 0.22483125 Ni 12.20827496 5.19432142 10.44054579 0.22912750 0.31907596 -0.11083288 Ni 12.17065733 3.49154962 12.20328081 0.07596916 -0.35395487 0.03866465 Ni 10.45852587 5.19084901 12.15290493 -0.23895094 0.42516717 0.32405420 Ni 0.01773169 6.99072535 10.42399540 -0.30793704 -0.19819868 0.11414844 Ni 1.72095618 8.73608333 10.45437590 0.60816851 -0.56022078 -0.21815288 Ni 1.73081184 6.95221305 12.21147603 0.25256353 0.29033459 -0.06495952 Ni 0.00239478 8.67561954 12.16557101 -0.05174376 0.28774066 0.22519348 Ni 3.46627528 6.98443146 10.44548314 -0.18210015 0.07842378 -0.19972937 Ni 5.25233076 8.73872466 10.43032438 -0.59480793 -0.26918671 -0.02688509 Ni 5.19648307 6.95947779 12.15780892 0.08724741 0.35168670 0.40090592 Ni 3.48157120 8.73463281 12.19333292 -0.10208995 -0.45559679 0.04134227 Ni 6.95502911 6.99857729 10.46218368 0.22520974 -0.39284514 -0.30158783 Ni 8.72438520 8.70009413 10.41624618 -0.09276210 0.35594097 0.36682269 Ni 8.73862695 6.99895342 12.19595081 -0.21097477 -0.35075364 0.02029163 Ni 6.94340916 8.71991587 12.18315442 0.20868115 -0.02519781 0.16311216 Ni 10.46881948 6.98139612 10.45758923 -0.46012085 -0.29438496 -0.48897093 Ni 12.17257430 8.73880608 10.47254700 0.19850143 -0.06117699 -0.41723581 Ni 12.14173670 6.98171782 12.18024545 0.28010388 -0.24076965 0.10228709 Ni 10.44072000 8.70234927 12.18826577 -0.28256579 0.49057259 0.21143947 Ni 0.03031366 10.43357878 10.46714622 -0.43164099 0.12920738 -0.13516643 Ni 1.77389215 12.18409452 10.45286473 -0.25641397 0.32750203 -0.19261229 Ni 1.76931801 10.42894387 12.15773116 -0.45090603 0.14904470 0.78754449 Ni 0.02229055 12.19255059 12.17093669 0.42530621 -0.36936059 -0.34444672 Ni 3.45180314 10.48033611 10.47742740 0.48787831 -0.77665025 -0.72355580 Ni 5.20318400 12.17785372 10.41599558 0.34793175 0.28985891 0.35572790 Ni 5.19907539 10.42004954 12.17961914 0.39914926 0.36300407 0.18648094 Ni 3.49109896 12.15954020 12.19853093 -0.08630611 0.25890381 0.16065426 Ni 6.94779740 10.47875748 10.43225689 0.35171136 -0.28503685 0.28175561 Ni 8.70401290 12.17926291 10.42269205 0.14458586 0.33440992 0.22998521 Ni 8.67888318 10.44376007 12.22026940 0.35013725 -0.16429618 -0.21273609 Ni 6.98485353 12.19340725 12.21681873 -0.28635226 -0.15066265 -0.30078606 Ni 10.44828067 10.48066301 10.46749170 -0.47981981 -0.44826740 -0.21968614 Ni 12.17261145 12.17201610 10.41493032 0.13662091 0.17280457 0.14108555 Ni 12.14141178 10.45288776 12.17622638 0.22176899 -0.05399921 0.27127548 Ni 10.43721461 12.20512199 12.19996410 -0.35187648 -0.04508918 -0.15752408