500 Lattice="17.507788175834428 0.0 0.0 0.0 17.507788175834428 0.0 0.0 0.0 17.507788175834428" Properties=species:S:1:pos:R:3:forces:R:3 energy=-2052.6859077785057 stress="-0.010797830633541372 0.00037898786290188835 9.889944296906752e-05 0.00037898786290188835 -0.010889463877502338 -0.0005456563333415014 9.889944296906752e-05 -0.0005456563333415014 -0.010716185137622897" free_energy=-2052.6859077785057 pbc="F F F" Ni 0.00156210 0.03382919 0.03377892 0.37834005 0.20578268 0.20777158 Ni 1.76278358 1.76806781 0.03181241 0.20591991 0.15482094 -0.41278468 Ni 1.76154340 0.02692535 1.77438495 0.11763326 -0.59248206 -0.18958374 Ni 0.03225523 1.74978795 1.73255456 -0.44690546 0.23942296 0.60939855 Ni 3.51644477 0.03854135 0.00605890 -0.24895421 -0.10535856 0.07758516 Ni 5.26230358 1.72134530 0.02376736 -0.29111198 0.39920371 -0.56441772 Ni 5.23661693 0.00730877 1.76616703 0.17526122 -0.41206994 0.10120432 Ni 3.49233747 1.75809327 1.77051546 0.24558946 0.30165169 -0.13628218 Ni 7.01502915 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3.47129490 0.00752516 0.13355544 0.14895231 -0.29644081 Ni 15.78573212 5.24697068 0.02633569 -0.19248419 -0.21892481 0.06578322 Ni 15.77773849 3.48362473 1.77505715 0.26873287 0.06011756 -0.06142364 Ni 13.99406427 5.22652525 1.72843239 0.21154675 0.08916315 0.31773420 Ni 0.02629427 7.02900988 0.00302663 -0.16582619 -0.22949718 0.16027110 Ni 1.75591442 8.72049729 0.01686384 0.31942747 0.34651834 -0.45612474 Ni 1.74923757 7.01779669 1.77904522 0.17321617 -0.15156137 -0.19402372 Ni 0.03056867 8.78191917 1.71915332 -0.60809510 -0.22311124 0.66571973 Ni 3.51197548 6.99649269 0.00071663 -0.25048618 0.35651349 -0.37107164 Ni 5.28403372 8.74396044 0.00140205 -0.27387624 0.20867765 -0.25897846 Ni 5.22842557 7.00615179 1.72675400 0.49301411 0.19154854 0.56864380 Ni 3.48935896 8.78868788 1.76766087 0.13601891 -0.40394860 0.10022445 Ni 7.01539742 7.00442649 0.01624228 0.14154936 0.06589244 -0.24006935 Ni 8.78776928 8.77007676 0.02537900 -0.33544665 -0.26676772 -0.43007846 Ni 8.75474594 7.02162399 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0.03368705 0.23981062 0.04869889 -0.45121829 Ni 5.26760601 12.22248272 0.02867823 -0.46262978 0.32732117 -0.57979808 Ni 5.27879403 10.49170068 1.77941128 -0.60142297 0.13579054 -0.20670313 Ni 3.51452876 12.27204867 1.71939246 -0.08744700 -0.28976497 0.53111133 Ni 7.00174024 10.53526494 0.01320837 0.13842403 -0.40911052 -0.40234602 Ni 8.75291417 12.26569100 0.02964891 -0.15929291 -0.10284933 -0.51888692 Ni 8.75695770 10.48182390 1.71882761 -0.17181660 0.41469281 0.67102502 Ni 6.96994885 12.27114378 1.73982527 0.42561602 -0.30281342 0.43377734 Ni 10.50389585 10.53334748 0.00147801 0.10885965 -0.24189964 -0.37125248 Ni 12.25363405 12.23722714 0.02503703 0.12580090 0.30888167 -0.51552670 Ni 12.25388370 10.52479017 1.76857508 0.18383361 -0.47948223 -0.13093108 Ni 10.51690749 12.24262186 1.74913201 -0.05644377 0.19459107 0.29430007 Ni 14.02648721 10.51958539 0.00466471 -0.30431761 -0.16121210 -0.36241653 Ni 15.76970777 12.31847737 0.03186615 -0.21221124 -0.24029575 0.02552267 Ni 15.73398014 10.47956317 1.74675636 0.32930008 0.29199910 0.17680888 Ni 13.98621974 12.22118533 1.74532991 0.19959260 0.58132004 0.12284434 Ni 0.03327962 13.99190102 0.03137091 -0.12983342 -0.44201393 -0.28184086 Ni 1.74211917 15.75869989 0.01520300 0.48082758 0.08090651 0.00334221 Ni 1.74576296 14.03573780 1.71738061 0.34973919 -0.55649329 0.66146773 Ni 0.00827332 15.72203037 1.72106276 -0.15915043 0.16606813 0.55839303 Ni 3.49157806 14.03325020 0.01189134 0.25474315 -0.21313973 -0.28323381 Ni 5.27306051 15.71804394 0.03234525 -0.23953615 0.34800761 -0.14959099 Ni 5.26624000 14.02127469 1.75725213 -0.47753189 -0.34582117 0.25041644 Ni 3.52568261 15.77711928 1.80472318 -0.25054435 0.19325574 -0.37149905 Ni 6.96898557 13.99882512 0.03137208 0.38661869 -0.22524002 -0.49725555 Ni 8.69728989 15.74700900 0.05837628 0.26571779 -0.01506928 -0.15292101 Ni 8.77660929 13.98376129 1.73329916 -0.36249573 0.23674607 0.55922097 Ni 6.97769272 15.76229309 1.77756303 0.26627538 0.20956405 0.28604176 Ni 10.48457361 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8.72379954 12.26979533 -0.39409744 0.12224893 0.14723864 Ni 3.50319072 6.98886874 10.52253411 -0.27571589 0.25366315 -0.13500239 Ni 5.24514346 8.76035013 10.48811867 0.09353119 -0.11788659 0.04694539 Ni 5.24460688 7.00552777 12.24867558 0.37520703 -0.12289710 0.13789532 Ni 3.51575770 8.75534487 12.22615518 -0.17241570 -0.11691837 0.42671808 Ni 7.03344191 7.00761328 10.48730986 -0.27416614 -0.03862739 0.21802134 Ni 8.74758283 8.75872487 10.51053035 0.34469138 0.10785919 -0.33314841 Ni 8.77166655 7.02830606 12.24535011 -0.07891290 -0.43753297 0.11541845 Ni 6.98277019 8.75919258 12.20334468 0.27085421 -0.06375430 0.44151666 Ni 10.53739664 6.99042451 10.49431460 -0.29323353 0.08341014 0.11982344 Ni 12.27985311 8.74704689 10.48430869 -0.20673031 -0.04841901 0.31780574 Ni 12.26942877 7.02443514 12.28871001 -0.30198718 -0.22613631 -0.36111170 Ni 10.49095223 8.73953935 12.26244354 0.35616537 0.23268987 0.14773904 Ni 14.01822710 7.02710184 10.53833051 -0.15687596 -0.35329970 -0.26945192 Ni 15.79046612 8.77604657 10.51158541 0.15927783 -0.30154462 -0.14121671 Ni 15.75057842 7.01585023 12.28371050 0.24234141 -0.12378048 -0.22780487 Ni 13.97883629 8.77853885 12.27470009 0.50500452 -0.28762597 -0.36101486 Ni 0.00105812 10.47356855 10.49111865 -0.26897507 0.40696141 0.24452972 Ni 1.75592095 12.26300004 10.53313886 0.21678358 -0.50277536 -0.47355374 Ni 1.76436168 10.47444340 12.23655482 -0.05558689 0.43100132 0.46879990 Ni 0.03480671 12.28261817 12.23160598 -0.52792497 -0.53553404 0.17446005 Ni 3.52016793 10.49548716 10.53302463 -0.12992721 0.37224352 -0.34951807 Ni 5.28327238 12.24881699 10.47074453 -0.39464981 0.02022669 0.40407841 Ni 5.26133894 10.52440165 12.26573740 -0.27880565 -0.24241131 -0.28542368 Ni 3.49921395 12.28913104 12.24493542 0.21123577 -0.32715348 0.24555152 Ni 6.99143699 10.50142053 10.47569218 0.11709779 -0.03830110 0.24185791 Ni 8.73072840 12.24598826 10.49831733 0.37832779 0.02857086 0.16422001 Ni 8.77640063 10.51747270 12.22095110 -0.26432467 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10.47619467 0.56854688 0.53022089 0.36640642 Ni 5.28440539 15.77609499 10.47763942 -0.45622651 0.06608706 0.22936529 Ni 5.23608673 14.03930152 12.22300493 0.22865945 -0.40213769 0.16506876 Ni 3.49915671 15.76672564 12.28780149 0.09764340 0.23020631 -0.51294325 Ni 7.01102384 13.98989655 10.48443869 -0.02185478 0.13173044 0.33300871 Ni 8.77621094 15.75647383 10.49931544 -0.31592984 0.35242467 -0.15569797 Ni 8.76639091 14.03289314 12.26522852 -0.24876067 -0.76040368 -0.23894998 Ni 7.03675942 15.79005532 12.22009547 -0.23709981 0.10416171 0.16215245 Ni 10.47595065 14.02460014 10.52114698 0.50942380 -0.42543307 -0.32915722 Ni 12.26264316 15.74835060 10.51075459 0.09566016 0.15030231 -0.19538747 Ni 12.28258483 13.99254953 12.25480129 -0.20669487 -0.08560227 -0.18869236 Ni 10.49762131 15.73629996 12.24553561 0.32975763 0.66048355 0.04556895 Ni 14.02010018 13.99333947 10.52560639 -0.39993424 -0.27565380 -0.44954888 Ni 15.73991678 15.73576665 10.47471790 0.16134464 0.13922183 0.12657829 Ni 15.72631795 14.00024572 12.22462216 0.70672354 -0.20199907 0.36484826 Ni 14.03654559 15.73062115 12.22719412 -0.44159168 0.53117009 0.40193812 Ni 0.00778705 0.02657993 14.00568293 0.11970828 -0.12572998 -0.27459399 Ni 1.77257446 1.72195501 14.02161188 -0.27179399 0.64544192 -0.43267525 Ni 1.74952604 0.02186839 15.77918981 0.26045732 -0.15284470 -0.09390215 Ni 0.04245626 1.74732141 15.72310279 -0.12918528 0.55252581 0.10542764 Ni 3.47197368 0.02363518 14.00401948 0.18385655 -0.79981968 -0.07373208 Ni 5.21885258 1.72483421 13.98835219 0.37004231 0.78138138 0.36085573 Ni 5.24712655 0.00055314 15.76723788 0.00119368 0.20443624 -0.17068283 Ni 3.48682237 1.73319918 15.74521905 0.30555616 0.33621211 0.46747951 Ni 6.97620005 0.02887795 14.01177181 0.37773223 -0.44466898 -0.09815147 Ni 8.78001694 1.71585788 13.98958578 -0.29636692 0.51402186 0.07541468 Ni 8.76767334 0.01270348 15.76092148 0.00090628 0.00865824 -0.22329808 Ni 7.03351136 1.75891289 15.74645597 -0.21969839 0.20056328 0.19067505 Ni 10.54390230 0.02257666 13.98643653 -0.14354441 -0.47757953 0.10579729 Ni 12.28246794 1.74858077 13.98604991 -0.14347504 0.41576680 0.46348062 Ni 12.29129829 0.02262457 15.74710114 -0.12825219 0.12476368 -0.01663314 Ni 10.49680048 1.75912582 15.75304042 0.31263969 0.22390968 0.14253027 Ni 14.02923876 0.02199679 14.02725061 -0.16282642 -0.36944259 -0.27028401 Ni 15.77927331 1.75209696 14.03565457 0.13339421 0.13092820 -0.56596385 Ni 15.78460513 0.02662198 15.74699953 -0.36175955 0.25715596 -0.21971701 Ni 14.03276150 1.76815571 15.75709982 -0.37106379 0.19573186 0.19306560 Ni 0.02029780 3.52956781 13.99669442 -0.19892263 -0.52394639 -0.20377664 Ni 1.75440974 5.21894682 14.01857843 0.27437247 0.38138781 -0.10462634 Ni 1.79972057 3.49946858 15.76082557 -0.28983541 -0.02277589 0.42707293 Ni 0.01537864 5.24703030 15.74654473 0.06336035 -0.14505461 0.13334185 Ni 3.46772491 3.51238372 14.02067662 0.58066986 -0.25692541 -0.42458794 Ni 5.22088845 5.22883642 14.02484460 0.49075197 0.12036047 -0.52527147 Ni 5.25692617 3.50213809 15.75976663 -0.06203924 -0.15860064 0.19393107 Ni 3.50761408 5.28722180 15.78681937 -0.31438826 -0.28521149 0.19710364 Ni 7.03238438 3.53473531 14.03208532 -0.36423751 -0.64663826 -0.53636966 Ni 8.75078819 5.24778180 14.01524653 0.31837221 0.30528092 -0.36307676 Ni 8.77604352 3.52204484 15.75797718 -0.07497317 -0.31316850 0.23998536 Ni 7.02597262 5.27094825 15.73733137 -0.42623877 -0.22712998 0.51686557 Ni 10.50853833 3.49826221 13.97168304 0.25698130 -0.07735785 0.58968439 Ni 12.27599676 5.24230967 13.99923947 -0.26772139 0.08585003 0.15828304 Ni 12.27703794 3.52983195 15.75889317 -0.06748427 -0.31932374 0.09442567 Ni 10.49415702 5.24345620 15.77407007 0.31452956 0.19597043 0.04206529 Ni 14.03400644 3.52821752 13.97292788 -0.66189376 -0.63088493 0.32319990 Ni 15.72727876 5.21896975 13.97233776 0.57469461 0.63285426 0.10151868 Ni 15.73220211 3.51623125 15.72726868 0.25005994 -0.09600163 0.16143457 Ni 14.03780163 5.25044197 15.77232792 -0.42252625 0.23736740 0.09112005 Ni 0.02989303 6.98109185 14.03821565 -0.47090398 0.26880219 -0.32292497 Ni 1.79498249 8.74255719 14.00964016 -0.40523425 0.16511583 -0.30240122 Ni 1.71909944 7.02245837 15.76796458 0.54916578 -0.39619408 0.29724621 Ni 0.02745012 8.74913846 15.76568704 -0.06666187 0.14813106 -0.15582491 Ni 3.48073527 6.98674840 13.98327730 0.17553572 0.13967559 0.11079902 Ni 5.26815093 8.75606949 13.97190701 -0.27391256 -0.14721640 0.28948777 Ni 5.22274911 6.96972529 15.73238666 0.49491437 0.47788142 0.28576190 Ni 3.48457450 8.70156725 15.74318992 0.28754883 0.41219952 0.35092103 Ni 7.02329548 7.00883812 14.00939983 -0.42657247 -0.20190025 -0.39167432 Ni 8.72137374 8.72493022 14.01278460 0.49551276 0.44155585 -0.21976740 Ni 8.72613553 6.97261240 15.78849702 0.49638115 0.41309897 0.18132544 Ni 7.02345699 8.75337996 15.76609942 -0.45426578 -0.19393299 0.26570336 Ni 10.50685394 7.02853303 14.02817050 -0.11148900 -0.34535267 -0.12955859 Ni 12.28365082 8.74618192 14.03095773 -0.68563942 0.22819167 -0.58202338 Ni 12.27960261 7.02782917 15.72302954 -0.25340344 -0.54410188 0.66038137 Ni 10.53109460 8.78620270 15.76314806 -0.33812551 -0.34975265 0.26112824 Ni 13.99628937 7.01693917 13.99880826 0.24149330 -0.42540289 -0.09382589 Ni 15.72503451 8.77027949 14.00461234 0.60526886 -0.17214448 -0.31775303 Ni 15.74379321 7.03191778 15.74607608 0.01527910 -0.23991304 -0.19808623 Ni 13.99716127 8.73745246 15.72446828 0.04548966 0.10811159 0.80195497 Ni 0.00608310 10.49019413 14.00716306 -0.09244775 0.03217463 -0.36892829 Ni 1.75353082 12.26370230 14.00194606 0.15561082 -0.19321481 -0.06363542 Ni 1.74891055 10.50333939 15.75684247 0.29576157 -0.04865373 0.26088044 Ni 0.00594730 12.22264434 15.74604500 0.04522475 0.22241185 -0.09979210 Ni 3.48350272 10.52535465 14.03173447 0.23524368 -0.32408118 -0.53202319 Ni 5.27218301 12.22301666 13.98150916 -0.25990138 0.67150753 0.14531254 Ni 5.24884582 10.48547037 15.75740538 0.04098964 -0.17670779 0.17402248 Ni 3.53437990 12.23366923 15.76140089 -0.36045199 0.29647430 0.21801592 Ni 7.00306941 10.47410975 13.98123748 0.16841300 0.17891522 0.07016791 Ni 8.73067824 12.23075052 14.01756853 0.35480325 0.12458679 -0.42067875 Ni 8.74250301 10.47320485 15.76512188 0.08861995 0.32845896 0.19123792 Ni 6.97771644 12.24157344 15.74746221 0.09373572 -0.01903648 0.21712401 Ni 10.51974354 10.53015753 14.03376216 -0.21285956 -0.44180008 -0.59966244 Ni 12.23455044 12.27158439 14.03259304 0.37969604 -0.21028951 -0.43935093 Ni 12.28542208 10.48381817 15.74117236 -0.06055792 0.29855346 0.58431951 Ni 10.53633217 12.23655708 15.76885998 -0.32570955 0.18016069 0.27102188 Ni 13.98926947 10.47069375 14.01549155 0.15620722 0.78040818 -0.37394299 Ni 15.77996463 12.26739432 14.00435056 0.17364684 -0.07870341 -0.13079159 Ni 15.72513892 10.47859991 15.73470129 0.15573307 0.13406129 0.10012499 Ni 14.03324226 12.23866662 15.73685014 -0.49637474 0.19275398 0.27790615 Ni 0.00058308 13.97710548 13.96988444 -0.23642060 0.20663072 0.32146221 Ni 1.76164502 15.76073671 13.98041582 -0.33765922 0.25505312 0.09924917 Ni 1.72965324 14.00529906 15.75047985 0.09070089 -0.33223790 0.19007089 Ni 0.01248683 15.77115787 15.77231066 0.46407344 -0.52938315 -0.61878068 Ni 3.47709667 14.03800101 14.02604091 0.43085648 -0.80928405 -0.34915304 Ni 5.26018845 15.74183103 13.97801097 0.21928682 0.22702358 0.25229577 Ni 5.23761322 13.98205558 15.77900778 0.30281186 0.04825532 -0.12665262 Ni 3.47850682 15.70635920 15.74414698 0.12631463 0.28918385 0.12434693 Ni 7.03554320 14.02143706 13.97592714 -0.58629227 -0.25010946 0.13903592 Ni 8.76493571 15.73938535 13.99383192 -0.08444140 0.47022795 0.13188598 Ni 8.74795841 13.95025874 15.73979882 0.18083756 0.16608864 0.25611473 Ni 7.02957880 15.74762738 15.78822327 -0.11945546 -0.33047830 -0.37186339 Ni 10.52565487 14.04041238 13.96604173 -0.24267080 -0.87028831 0.29578033 Ni 12.26313416 15.74938080 14.01240988 0.17635080 0.29729055 -0.54573636 Ni 12.23549154 14.02057760 15.77371798 0.39033617 -0.56938989 0.13891424 Ni 10.52915897 15.71187639 15.72944561 -0.39885384 0.20377784 0.14527775 Ni 13.99569026 13.97245109 13.97559513 0.13630946 0.27778049 0.41186924 Ni 15.76601631 15.74202495 14.01235795 -0.32690838 -0.35641080 -0.21558051 Ni 15.73723430 13.99162491 15.79188400 -0.22443904 -0.10842261 -0.34237577 Ni 13.97132510 15.73910503 15.74451097 0.05399533 -0.16508532 -0.14741411