500 Lattice="17.464442440329158 0.0 0.0 0.0 17.464442440329158 0.0 0.0 0.0 17.464442440329158" Properties=species:S:1:pos:R:3:forces:R:3 energy=-1999.8615743678058 stress="-0.005293411402877925 -5.329273925015883e-06 0.00017778661535179736 -5.329273925015883e-06 -0.005457307122724755 0.0002300286406513741 0.00017778661535179736 0.0002300286406513741 -0.005339630531799322" free_energy=-1999.8615743678058 pbc="F F F" Ni 0.02046048 0.02939625 0.03378650 0.75501525 0.62879277 0.71734973 Ni 1.73066753 1.74470839 0.02968187 0.11918425 -0.23632513 -0.51547115 Ni 1.78806634 0.01395630 1.78109472 -0.27704566 -0.27285831 -0.22536183 Ni 0.01900112 1.74147960 1.71654538 -0.37001008 -0.14778054 0.29204311 Ni 3.52657696 0.00781965 0.01773118 -0.17561854 0.39061376 0.42904280 Ni 5.21985152 1.75348814 0.02393111 0.12754677 -0.00180228 -0.39128259 Ni 5.26217131 0.01741567 1.76819598 -0.20108914 -0.46956327 -0.18142023 Ni 3.49267456 1.77870983 1.72888559 -0.20407075 -0.28610652 0.22789478 Ni 6.96966761 0.01773837 0.01089052 0.12634391 0.42621861 0.42583240 Ni 8.73218815 1.77685255 0.02116009 -0.32323351 -0.38597738 -0.30365297 Ni 8.76520737 0.00683401 1.77484198 -0.42137746 -0.31666901 -0.34912996 Ni 6.96861545 1.71702318 1.76880439 0.38921346 0.39356298 -0.19440408 Ni 10.48417255 0.03439115 0.04030792 -0.15910161 0.07567026 0.01251406 Ni 12.20520577 1.73720857 0.02518892 0.20672968 0.23871610 -0.55697334 Ni 12.20882176 0.03280760 1.73260608 0.24710274 -0.69051487 0.16697383 Ni 10.47763182 1.73862216 1.72301137 -0.12707571 0.47568197 0.54626968 Ni 13.94531213 0.03331243 0.02088387 0.28952086 0.40328432 0.41576131 Ni 15.72436461 1.77629523 0.00223564 -0.63263602 -0.14281177 0.61794192 Ni 15.75271728 0.02150665 1.73764030 -0.72035370 0.70114678 -0.02461499 Ni 13.95646243 1.71522541 1.73211024 0.47628379 0.20493438 0.15765701 Ni 0.00685712 3.49102558 0.00093602 0.32601089 -0.02418497 0.27085904 Ni 1.75938797 5.24650921 0.02996836 -0.27414828 0.23259174 -0.48377866 Ni 1.72716856 3.49538091 1.71880421 0.16302589 -0.17905876 0.44911727 Ni 0.00651431 5.21790266 1.74123150 -0.34820239 0.19874191 -0.07661999 Ni 3.45847945 3.51567115 0.00433832 0.24217879 -0.18673902 -0.37772979 Ni 5.26601241 5.21106271 0.02932167 -0.34075217 0.24404667 -0.35689153 Ni 5.23887941 3.47363757 1.78475850 0.03490567 0.23731287 -0.24053477 Ni 3.46659360 5.22118133 1.75325288 0.23040122 0.18005272 0.29977998 Ni 6.96728700 3.50459839 0.01704746 0.18303308 -0.22134194 -0.19321057 Ni 8.74485814 5.26294444 0.01589182 -0.25181308 -0.21399423 -0.55979788 Ni 8.73863467 3.51879978 1.73943321 -0.15628930 -0.20062377 0.44362595 Ni 6.95327834 5.27096755 1.74349674 0.31413329 -0.06537125 0.25811420 Ni 10.44452345 3.46526133 0.02431042 0.37533220 0.23745303 -0.44306710 Ni 12.25009719 5.19619268 0.02259795 -0.29676393 0.23427732 -0.45627862 Ni 12.24874853 3.49778563 1.77475831 -0.34593092 -0.21729480 -0.11803211 Ni 10.47537939 5.25589949 1.71721305 0.32298941 -0.26745077 0.57795068 Ni 13.96141898 3.49414578 0.02976546 0.19999971 -0.28978873 -0.54599931 Ni 15.73661554 5.21540860 0.02611792 -0.45054938 0.18681578 0.33680430 Ni 15.68981658 3.51397444 1.72408181 0.37638771 -0.32454984 0.14288298 Ni 13.95124917 5.22684785 1.73418260 0.44305963 0.18789803 0.25047721 Ni 0.01541806 7.01429357 0.02763821 0.33918582 -0.20503353 0.23717862 Ni 1.72101681 8.77737998 0.02409931 0.16017286 -0.36156290 -0.38043012 Ni 1.72703725 6.99720063 1.77049721 0.41758651 -0.06535505 -0.06696422 Ni 0.01098343 8.71338817 1.72583897 -0.31543172 0.34034675 0.26486165 Ni 3.51826106 7.00851081 0.01999065 -0.46112226 -0.21772718 -0.36695892 Ni 5.22073592 8.71859449 0.01999157 0.27885489 0.25478538 -0.58466984 Ni 5.18894925 7.00163588 1.74990243 0.34998950 -0.49629543 0.17717275 Ni 3.52643786 8.73541520 1.76051470 -0.69658693 -0.09152303 0.15019209 Ni 6.99670579 7.01600897 0.00364340 -0.28272887 -0.35647298 -0.38129387 Ni 8.71257457 8.69827980 0.01433735 0.24073958 0.33245801 -0.30847691 Ni 8.76140035 6.96196562 1.71427552 -0.34041491 0.33768559 0.65938270 Ni 6.95955776 8.70979597 1.72069733 0.28655345 0.29794750 0.35631486 Ni 10.49303330 6.98072355 0.02202406 0.24331230 0.12157337 -0.46620330 Ni 12.21151182 8.74237099 0.00474445 0.20852826 -0.13947373 -0.38457768 Ni 12.25862678 6.98832433 1.77203116 -0.48600749 -0.09162792 -0.27843564 Ni 10.50691653 8.74723233 1.75999663 -0.27453888 -0.30068705 0.05598316 Ni 13.96927113 6.96135675 0.01443394 0.23335186 0.11135647 -0.33893744 Ni 15.74392512 8.72569741 0.02547690 -0.55324767 -0.04952418 0.34363164 Ni 15.72748901 7.00337679 1.76547735 0.14537165 -0.21406943 -0.15766677 Ni 13.95120356 8.71251572 1.72675970 0.25355646 0.29121181 0.14161612 Ni 0.01177511 10.50635624 0.00946380 0.17806822 -0.06813542 0.39423929 Ni 1.72192045 12.21208676 0.03347225 0.17847784 0.31294690 -0.68821689 Ni 1.77412673 10.50465273 1.71865633 -0.17922410 -0.38407408 0.41008803 Ni 0.02391185 12.25985163 1.75064620 -0.57446766 -0.01991227 -0.14071298 Ni 3.48870144 10.44476675 0.00593917 0.01615031 0.28282532 -0.42655259 Ni 5.21551157 12.21945179 0.00554843 0.13756853 0.12010947 -0.17553382 Ni 5.20840662 10.46395476 1.75378327 0.36549425 0.46393723 0.13815250 Ni 3.47124976 12.25363743 1.73467486 0.43196049 -0.19705636 0.35620440 Ni 7.00368116 10.51179293 0.01037732 -0.25188696 -0.31973100 -0.20780607 Ni 8.69915447 12.22049232 0.02022151 0.46773381 0.13888320 -0.25384133 Ni 8.72129637 10.45567550 1.78191559 -0.16886738 0.24974190 -0.16860234 Ni 6.98617812 12.25231784 1.73763098 -0.11150866 -0.15878038 0.52323054 Ni 10.46356259 10.45081593 0.02042490 -0.17042298 0.14003236 -0.42416004 Ni 12.21079206 12.21098895 0.02952986 0.14158884 0.13367685 -0.43356094 Ni 12.19575362 10.45505330 1.76108698 0.35072995 0.23036443 0.19155499 Ni 10.49080595 12.19365232 1.74109090 -0.27178599 0.51501671 0.23111353 Ni 13.96906424 10.49119361 0.03367682 0.10776881 -0.17111333 -0.40933119 Ni 15.70837204 12.23123414 0.03433174 -0.29615507 0.01133643 0.26884256 Ni 15.73562470 10.46454856 1.71626489 0.14102530 0.06126126 0.22965977 Ni 13.95467941 12.19801234 1.75857451 0.08582751 0.22931788 -0.05761585 Ni 0.02679261 14.00461315 0.00307332 0.43604871 -0.19086370 0.43403685 Ni 1.73095521 15.69815476 0.02395512 0.18133405 -0.43813664 0.38528090 Ni 1.76749849 13.94326671 1.76094495 -0.03917109 0.45297177 -0.04776116 Ni 0.02768606 15.68913462 1.71186944 0.34027434 -0.32237537 0.06779916 Ni 3.51507637 13.98768640 0.01223964 -0.21760125 0.09252523 -0.35150298 Ni 5.24662201 15.71940447 0.00736726 0.04541538 -0.46204768 0.54745343 Ni 5.22022375 13.98952853 1.78022943 0.19451957 -0.12490455 -0.33147370 Ni 3.46803103 15.71759185 1.75293265 -0.00938301 0.27981119 -0.00003987 Ni 7.00904196 13.97189737 0.02342942 -0.32954045 0.14116083 -0.37292248 Ni 8.75026909 15.69095664 0.00354079 -0.03329152 -0.19896246 0.26724532 Ni 8.75036729 14.00532508 1.75587584 -0.08595773 -0.70935856 0.12630130 Ni 7.01855681 15.69205328 1.75536895 -0.21050976 0.40430136 -0.17790777 Ni 10.48602429 13.98652555 0.00041096 -0.11103081 -0.20148559 -0.24324098 Ni 12.20634904 15.68923279 0.01917452 0.15548464 -0.26130078 0.35967000 Ni 12.22357165 13.97949219 1.73622469 -0.09556132 -0.13420237 0.09556118 Ni 10.44795299 15.68952755 1.77974826 0.48882410 0.55781462 -0.35818352 Ni 14.00061548 13.96941775 0.02658514 -0.07444126 0.12878130 -0.27709112 Ni 15.71900563 15.72071540 0.03126941 -0.84521025 -0.85132727 0.87372937 Ni 15.71359497 13.95344862 1.75570369 0.26704763 0.33591288 -0.10398823 Ni 13.95541645 15.69729434 1.77106355 0.30945316 0.37608479 -0.18990361 Ni 0.01696139 0.00347315 3.52570992 0.32779723 0.41846381 -0.22663335 Ni 1.72848080 1.73951643 3.52213928 0.28523127 0.28189239 -0.40745128 Ni 1.76076295 0.03171678 5.22056578 -0.15877787 -0.41193793 0.25460768 Ni 0.00015645 1.77573781 5.23186837 -0.27094806 -0.24278923 0.17799152 Ni 3.51623532 0.00806161 3.50301084 -0.21625959 -0.32033459 -0.27116133 Ni 5.22962036 1.74685537 3.47711637 0.25703843 0.25447934 0.15939627 Ni 5.21616042 0.03108983 5.21583339 0.28345300 -0.42103749 0.35074804 Ni 3.52634974 1.74790383 5.21664872 -0.38357994 0.15287599 0.25655265 Ni 7.00251434 0.03485501 3.52556913 -0.18875361 -0.61293876 -0.25986536 Ni 8.73109428 1.73702329 3.50978090 0.15721409 0.63653494 -0.44455841 Ni 8.72422985 0.01469180 5.20750884 0.06581900 -0.48617029 0.33540693 Ni 7.00902589 1.76125652 5.22651481 -0.38188783 0.24504929 0.20057704 Ni 10.47243422 0.01961923 3.46509457 0.22190178 -0.45495733 0.21878546 Ni 12.22069521 1.74493011 3.46456996 0.19308081 0.07859347 0.37779587 Ni 12.21445453 0.02905136 5.26808481 0.33673344 -0.38866175 -0.33066953 Ni 10.46866974 1.74326483 5.21656874 0.19093877 0.38199276 0.06492806 Ni 14.00360194 0.00898459 3.49563151 -0.01003312 -0.14453439 -0.03084021 Ni 15.72828037 1.77851327 3.49491965 0.19857139 -0.33116493 -0.26230744 Ni 15.72874268 0.01070053 5.25603909 -0.41013894 0.49139259 -0.09077669 Ni 13.99553041 1.77134684 5.24716117 -0.28551010 -0.35188400 -0.17091779 Ni 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12.22949817 3.50470722 5.25716079 0.00137454 -0.18556971 -0.13567570 Ni 10.50710389 5.22989763 5.22600192 -0.23570607 0.02410938 0.20812771 Ni 13.96039637 3.48531313 3.49372576 0.02159496 -0.12843770 -0.13747512 Ni 15.73261647 5.21715226 3.49568218 0.16790185 0.10722786 -0.18794469 Ni 15.70563093 3.46354817 5.24024080 0.49394761 0.23172113 0.16397977 Ni 13.99736708 5.20580012 5.21610292 -0.25502361 0.29467510 0.30014357 Ni 0.01973347 6.97681758 3.49289952 -0.31020330 0.12929946 -0.05266763 Ni 1.78057612 8.75480434 3.50878452 -0.29487900 -0.15263497 -0.31539149 Ni 1.74698110 6.99618312 5.26938314 0.14963205 -0.15543890 -0.44146804 Ni 0.01948868 8.71866415 5.23914008 -0.34153701 0.22058674 -0.19650120 Ni 3.48597595 6.96702190 3.50782685 -0.17481497 0.09659800 -0.30757172 Ni 5.25619747 8.71111497 3.46272602 -0.26395920 0.36340312 0.33039131 Ni 5.22425740 7.02437116 5.21325212 0.44457674 -0.21032357 0.39198787 Ni 3.49511201 8.72456535 5.21376580 0.11643723 0.23204766 0.28373092 Ni 6.97092394 7.01693879 3.46247705 0.39355817 -0.30233347 0.16333225 Ni 8.75700281 8.75187951 3.48054500 -0.34303804 -0.38074242 0.04944000 Ni 8.69906710 6.95253694 5.27238623 0.09446802 0.40317587 -0.56296501 Ni 6.98999104 8.75803679 5.20501168 -0.11519066 -0.21901023 0.42495996 Ni 10.45820125 7.00084914 3.47539470 0.20166656 -0.19593923 0.22339183 Ni 12.23825285 8.71487837 3.49760517 -0.21566706 0.28370277 0.31940900 Ni 12.23415483 6.95042485 5.24159758 -0.08351512 0.29436740 -0.01418323 Ni 10.44144172 8.72338851 5.24460157 0.31286659 -0.06289689 -0.21550597 Ni 13.93790334 6.96750611 3.46099998 0.54752263 0.02727603 0.39468316 Ni 15.69470359 8.74940868 3.48894163 0.27810856 -0.18132823 -0.13414415 Ni 15.73481574 6.94557769 5.25730673 0.05477328 0.19561701 -0.23430012 Ni 14.00028529 8.71846967 5.21463456 -0.42974790 0.04469643 0.24864052 Ni 0.01536550 10.50255500 3.45992086 -0.28001238 -0.25862119 0.10163765 Ni 1.74964390 12.19558872 3.46658889 0.14833438 0.50468612 0.23784417 Ni 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5.25590815 15.72017214 0.17603794 -0.11675730 0.32683666 Ni 0.01247824 6.99364977 14.01822775 -0.31224328 0.03195304 -0.31436521 Ni 1.77945757 8.70921760 13.99093559 -0.20157562 0.27741421 -0.19640849 Ni 1.72650555 7.00537242 15.73954935 0.13926608 -0.22249794 0.25754024 Ni 0.02255686 8.74134700 15.73251164 0.23034588 0.02856277 -0.40768354 Ni 3.51970134 6.96639302 13.99468152 -0.34880811 0.11285400 -0.23966423 Ni 5.21154651 8.72697928 13.99366225 0.15006891 0.14756674 -0.25000536 Ni 5.23268868 6.95956524 15.72130737 -0.08362991 -0.04927728 0.41397568 Ni 3.47467786 8.72173211 15.72492006 0.15752525 0.17613226 0.36286447 Ni 6.96469522 7.00464542 14.00405186 0.09834812 -0.34523173 -0.49517924 Ni 8.74813205 8.70237898 13.98625021 -0.32098335 0.53571135 -0.15178276 Ni 8.71562831 6.95843775 15.70856147 0.06085235 0.08338218 0.45219268 Ni 6.95577307 8.70016993 15.73810525 0.18527999 0.27837746 0.24647625 Ni 10.47612800 7.01720715 13.98550333 0.23465220 -0.48594197 -0.28982584 Ni 12.22531081 8.70315740 14.00485251 0.29092852 0.36881311 -0.50453865 Ni 12.19115418 6.99929516 15.74511733 0.41438139 -0.07981173 0.25507383 Ni 10.49080520 8.73742562 15.68623374 -0.28713074 0.22380385 0.56311882 Ni 13.93884206 6.94410653 13.96264335 0.15129575 0.40674520 0.19088813 Ni 15.68428393 8.73913894 13.98958752 0.35108997 -0.09112930 -0.05025710 Ni 15.74834189 7.00997709 15.68673409 -0.63726887 -0.07894939 -0.39583482 Ni 13.95728944 8.75891584 15.70855649 0.22657128 -0.19752014 0.26318160 Ni 0.00967788 10.50672107 13.97429788 -0.20999953 -0.22065956 -0.03310408 Ni 1.77789943 12.21659958 13.98422164 -0.11604893 0.20156125 -0.13375748 Ni 1.71573385 10.45873516 15.71109617 0.22375296 0.20820680 0.28318154 Ni 0.01102872 12.23154087 15.71126693 0.38510723 0.11430979 -0.43023062 Ni 3.49944457 10.48621803 13.95155534 -0.00776090 -0.04154663 0.17500754 Ni 5.20714640 12.21826940 13.97982465 0.36226167 0.11402041 -0.29827607 Ni 5.25467422 10.50326529 15.73478687 -0.19091702 -0.19573583 0.26851722 Ni 3.50269355 12.23986364 15.73315588 -0.18281227 -0.18213997 0.33951100 Ni 6.96224779 10.48350624 13.99248943 0.09391351 -0.30782726 -0.20744432 Ni 8.70428662 12.19660925 13.98694496 0.22351279 0.50799045 -0.13629355 Ni 8.71148032 10.50300934 15.70607706 0.10990413 -0.29131278 0.29916776 Ni 6.97104458 12.25772987 15.72889423 0.14898975 0.00729130 0.21008281 Ni 10.50570966 10.51199649 13.94225994 -0.14653572 -0.50090043 0.33024695 Ni 12.19520452 12.21235802 13.97555426 0.34882250 0.11813734 -0.18222436 Ni 12.21953450 10.48393158 15.73981794 0.09679525 0.08080152 0.15078532 Ni 10.47595717 12.24017389 15.74342175 -0.12920721 -0.12347313 0.18939904 Ni 13.97153367 10.50724240 13.95343732 -0.29637990 -0.29078503 0.22430099 Ni 15.69487090 12.22271550 13.96869729 0.57928585 0.39692350 0.23788913 Ni 15.70582418 10.52125685 15.68500508 -0.36100629 -0.14736997 -0.24189291 Ni 13.96600305 12.25569449 15.68640182 0.10050485 -0.10996733 0.53251381 Ni 0.02296320 13.97961186 13.93814125 -0.25517209 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