108 Lattice="10.439339655723344 0.0 0.0 0.0 10.439339655723344 0.0 0.0 0.0 10.439339655723344" Properties=species:S:1:pos:R:3:forces:R:3 energy=-407.71443296931034 stress="-0.010293626617518363 -0.0001229128001749633 -0.00024355901221755844 -0.0001229128001749633 -0.009396705692124132 -0.0002788227214361936 -0.00024355901221755844 -0.0002788227214361936 -0.009995762265741285" free_energy=-407.71443296931034 pbc="F F F" Ni 0.00092043 0.00085570 0.03012877 0.56454554 0.55085246 0.47686888 Ni 1.76620995 1.76217843 0.00561893 -0.30149300 -0.36973965 -0.45187830 Ni 1.76470853 0.00595201 1.71846334 -0.21783584 -0.40936632 0.10782019 Ni 0.03068971 1.74493851 1.73640587 -0.41276074 -0.12171379 -0.17344866 Ni 3.50476724 0.00218764 0.03163688 -0.10045809 0.27197201 -0.01679905 Ni 5.22383550 1.77090796 0.02239477 -0.03068852 -0.43398163 -0.38295413 Ni 5.19264744 0.00602223 1.73632595 0.40824395 -0.21459341 0.06635561 Ni 3.45559901 1.76607851 1.78954297 0.54573043 -0.24979753 -0.41881079 Ni 6.99232723 0.01075860 0.02351510 -0.19659201 0.27695480 0.20412322 Ni 8.68350640 1.79122116 0.03172252 -0.12061637 -0.14226021 -0.09139889 Ni 8.71327863 0.05973400 1.74065766 -0.00110182 -0.12379796 -0.00387542 Ni 6.98244696 1.71985881 1.75696508 -0.43600835 0.27147879 -0.19255419 Ni 0.01863007 3.52141284 0.00570968 0.17556039 -0.19165649 0.09845667 Ni 1.77208573 5.23246398 0.03226793 -0.26570331 -0.12166366 -0.55078034 Ni 1.75947337 3.46601739 1.73414173 -0.14004970 0.13622849 0.27164749 Ni 0.02353796 5.17973292 1.77071846 -0.46438972 0.22256090 -0.07966150 Ni 3.46634421 3.46967638 0.02004524 0.21651769 0.17855825 -0.39451797 Ni 5.20804785 5.19583359 0.02157300 -0.14321989 0.27691189 -0.23822344 Ni 5.23669318 3.45567361 1.73453759 -0.19631678 0.24670656 0.50156931 Ni 3.44911357 5.24368737 1.77219126 0.52713997 -0.38686754 -0.18301491 Ni 6.92751961 3.49959060 0.03364013 0.40038376 -0.03531013 -0.55399152 Ni 8.68849910 5.25067429 0.01434557 -0.06621652 -0.17629372 -0.13738388 Ni 8.70286099 3.49738618 1.71051062 0.29404626 0.07405691 0.32625196 Ni 6.97918582 5.24055388 1.75092761 -0.30158476 -0.32817902 0.09526726 Ni 0.02996398 6.95401113 0.03811425 -0.03389953 -0.16096765 0.04061364 Ni 1.73416822 8.68268684 0.01508936 0.27647029 -0.08986668 -0.00998899 Ni 1.71212539 6.95781398 1.74198294 0.38000308 0.02121892 0.26284073 Ni 0.06572540 8.72271733 1.70993629 -0.25418019 -0.10732425 0.17828927 Ni 3.46989021 6.95459122 0.01919245 0.21811411 0.09823085 -0.36026147 Ni 5.19213350 8.71293851 0.00736739 0.18607928 -0.33439128 0.19683654 Ni 5.21010574 6.93666436 1.79040470 0.11817719 0.31235028 -0.47506426 Ni 3.50339371 8.68960892 1.73096197 -0.27424969 0.31383824 0.13231671 Ni 6.93945246 6.94910456 0.02912595 -0.14566681 0.17249094 -0.59318823 Ni 8.69563027 8.68254011 0.02041958 -0.41820046 -0.47583590 0.35847336 Ni 8.68722152 6.93974319 1.71685290 0.62272648 0.40409915 0.35307936 Ni 6.97407566 8.67576494 1.71570978 -0.15328440 0.51156873 0.25389790 Ni 0.00301638 0.01705937 3.48385274 0.26276574 0.11610487 -0.09313276 Ni 1.76384788 1.72204788 3.47142001 -0.06917752 0.24163318 0.38273712 Ni 1.75671883 0.02569550 5.24108372 -0.03320256 -0.49996799 -0.29882822 Ni 0.01252704 1.75286081 5.19619046 -0.26472028 -0.15993776 0.29489676 Ni 3.50951630 0.01295546 3.48290812 -0.21206116 -0.48053985 0.12537027 Ni 5.24799909 1.72813779 3.50251390 -0.27630192 0.39941965 -0.29607849 Ni 5.23681497 0.02883412 5.22431255 -0.06968038 -0.69836579 0.08182880 Ni 3.50969527 1.74162077 5.24611148 -0.27635684 0.19025610 -0.46920482 Ni 6.98434656 0.02775773 3.50074578 -0.29701617 -0.83798162 -0.50471398 Ni 8.67837276 1.75441906 3.45630719 0.78432832 0.22270490 0.22368369 Ni 8.66917026 0.01665072 5.18147419 0.19019932 0.00549734 0.33176348 Ni 6.96069204 1.71548582 5.19600540 0.05345500 0.66261473 0.71029261 Ni 0.01327856 3.44075597 3.48446926 -0.24636229 0.30383124 0.09010543 Ni 1.76840467 5.19107711 3.46302219 -0.30286277 0.23060980 0.42160303 Ni 1.76384560 3.49279554 5.24080228 -0.06274227 -0.37483302 -0.30346030 Ni 0.02451287 5.25229181 5.23442392 -0.62781308 -0.48570020 -0.52970108 Ni 3.51241163 3.48414795 3.49139067 -0.13544103 -0.18317007 -0.01922871 Ni 5.24980152 5.19623041 3.45654328 -0.14939585 0.16764416 0.40078536 Ni 5.20676221 3.50369411 5.24610313 0.50691078 -0.29890963 -0.23631604 Ni 3.47540903 5.19328536 5.22047950 0.14035594 0.63528299 0.06020902 Ni 6.96557562 3.46416727 3.50093418 -0.22212586 0.25351186 -0.25416463 Ni 8.68535043 5.21809737 3.48380679 0.36240252 0.11789594 0.03616355 Ni 8.66654133 3.50752135 5.22449904 0.49862911 -0.29261647 0.09332445 Ni 6.94430901 5.24850601 5.23825267 0.08938707 -0.19818819 -0.32392129 Ni 0.00666094 6.95943022 3.49302769 -0.41827403 0.05989375 -0.22205487 Ni 1.72067751 8.69642050 3.44661283 0.33256418 0.34152133 0.30074350 Ni 1.70889962 6.96647090 5.22165929 0.68827965 0.07885213 -0.29573368 Ni 0.02406766 8.70905367 5.23732161 0.10552000 -0.08538228 0.01126182 Ni 3.49164164 6.95230037 3.48693971 -0.27936892 0.09297961 0.29261378 Ni 5.19711715 8.73214995 3.50516839 0.15903008 0.26175678 -0.17188659 Ni 5.23132894 6.98259267 5.21903095 -0.27752358 -0.21720364 -0.07795839 Ni 3.44985442 8.70859274 5.25208269 0.11733415 0.27793163 -0.39240317 Ni 6.96575639 6.99043522 3.47220707 -0.01044201 -0.03314565 0.15418756 Ni 8.73135128 8.72921111 3.49778652 -0.37469551 -0.36321639 -0.18457969 Ni 8.67058372 6.98405805 5.22418836 0.37642725 -0.04591171 0.13707179 Ni 6.95739333 8.72148214 5.22528743 0.02193401 0.26456069 0.18028721 Ni 0.02302943 0.00459769 6.93690835 0.12148881 0.23753636 0.03776244 Ni 1.77033501 1.72039175 6.96065372 -0.40358126 0.39654758 0.04188726 Ni 1.72085360 0.05597224 8.70378202 0.22334717 -0.07599242 -0.17480525 Ni 0.00704566 1.71585905 8.68885224 0.19759636 0.34066188 -0.36311019 Ni 3.50010091 0.00779687 6.95210910 -0.03574459 -0.49931684 0.24227143 Ni 5.20829736 1.76802718 6.95817888 0.45626594 -0.22728954 0.11444519 Ni 5.19949745 0.01202729 8.70917202 0.16042094 0.18602572 -0.20909428 Ni 3.49430015 1.74583767 8.69655792 -0.22669676 -0.08630773 0.48484117 Ni 6.94888821 0.00991639 6.95953948 0.13106058 -0.39052476 0.06274812 Ni 8.72757445 1.72448059 6.97286602 0.30033774 0.01329333 -0.32513335 Ni 8.72166678 0.01581315 8.67565305 -0.42599770 0.33453457 -0.40230294 Ni 6.99226393 1.71295847 8.66701589 -0.25240551 0.01091596 0.60439676 Ni 0.00644902 3.49131450 6.93033251 -0.31907500 -0.21417315 0.29887461 Ni 1.71567899 5.24095378 6.92728232 0.58674366 -0.26720287 0.38560474 Ni 1.74614222 3.51387422 8.67347194 -0.21544453 -0.33508144 0.30608995 Ni 0.01392402 5.24457229 8.68954547 0.12065218 -0.04695231 -0.13483523 Ni 3.48845179 3.45636250 6.96436905 -0.10695944 0.59863490 0.12514074 Ni 5.24370963 5.23308120 6.92735743 -0.53973829 -0.16657829 0.70376109 Ni 5.20759079 3.45611471 8.73267027 0.24066938 0.35599887 0.10826208 Ni 3.44601033 5.23828924 8.70795762 0.39873305 -0.21138959 0.06390413 Ni 6.98936145 3.46074552 6.98576842 -0.47376309 0.12317336 -0.22366549 Ni 8.67309426 5.21501572 6.97669949 0.46913336 0.16127769 0.03264569 Ni 8.69541034 3.46086564 8.70403989 -0.08657975 0.10610431 -0.04711412 Ni 6.95192453 5.24366583 8.72184620 -0.16881048 -0.29232639 0.34454540 Ni 0.02243805 6.93955029 6.93959788 -0.53956660 0.64893955 0.45429081 Ni 1.77388063 8.73039858 6.96468006 -0.62838109 0.29652641 0.13686690 Ni 1.76683508 6.96611750 8.68224807 -0.60967192 0.15513285 0.48432666 Ni 0.00088288 8.71064553 8.67231563 0.61808378 -0.64168631 -0.61377377 Ni 3.44604130 6.97780047 6.96983487 0.35872277 -0.57409632 -0.49906286 Ni 5.18988347 8.67404558 6.99263307 0.24959774 0.55233364 -0.36185184 Ni 5.17347510 6.98604428 8.71613852 0.23376449 -0.44343853 0.38615061 Ni 3.46975482 8.68356202 8.69144512 -0.07329648 0.32166120 0.27603248 Ni 6.93368771 6.93793762 6.99366640 0.36049817 0.60502016 -0.15499726 Ni 8.69927136 8.72302439 6.96156486 -0.44935603 -0.49741079 0.10986283 Ni 8.67929493 6.94575798 8.72112295 -0.20925100 0.21624064 -0.36185344 Ni 6.93051304 8.68937044 8.69173015 0.19402236 -0.22669547 -0.20558570