256 Lattice="13.938006535100413 0.0 0.0 0.0 13.938006535100413 0.0 0.0 0.0 13.938006535100413" Properties=species:S:1:pos:R:3:forces:R:3 energy=-1318.9370523718862 stress="-0.007578481138284169 -0.00036174844198864605 2.150448625108203e-05 -0.00036174844198864605 -0.007621802767239991 -0.0005961244980925146 2.150448625108203e-05 -0.0005961244980925146 -0.007800086704910896" free_energy=-1318.9370523718862 pbc="F F F" Ni 0.00973960 0.00657850 0.01532962 0.15139301 0.13328125 0.17136480 Ni 1.72229937 1.74371847 0.00225674 0.05096569 -0.21604398 -0.15493390 Ni 1.76655430 0.03483547 1.75068905 -0.25455256 -0.13186912 -0.13984502 Ni 0.02953379 1.77203513 1.71252101 -0.20106999 -0.33961953 0.16135984 Ni 3.50441301 0.04414003 0.00489968 -0.15339954 0.02045958 0.18479560 Ni 5.19395778 1.71321672 0.03229820 0.40019610 0.17459816 -0.10777652 Ni 5.20705194 0.02438516 1.77399149 0.29866987 -0.11524572 -0.35553609 Ni 3.48022674 1.74869777 1.74175394 0.12392516 -0.14432335 -0.32413711 Ni 6.95810203 0.01443474 0.01030917 0.03725972 0.25070354 0.28747875 Ni 8.72696420 1.77429306 0.02725963 -0.29248286 -0.48996423 -0.34295607 Ni 8.73238684 0.02188382 1.74128760 -0.23066493 -0.15681954 -0.12615840 Ni 6.98987131 1.72681309 1.74165674 -0.11106045 -0.24858572 -0.21183103 Ni 10.43437443 0.03132601 0.00920745 0.21056303 0.10904757 0.09737097 Ni 12.21521624 1.76106913 0.00988877 -0.20139003 -0.08493569 0.24629168 Ni 12.19927451 0.02839947 1.75437317 -0.23059480 0.21406534 -0.05628855 Ni 10.42206362 1.74547203 1.71933961 0.69924610 -0.24852355 0.09484175 Ni 0.01092569 3.46852453 0.00619336 0.17383538 0.21957117 0.18831679 Ni 1.75179335 5.20524705 0.06277889 -0.22671208 0.19692479 -0.32218328 Ni 1.75761891 3.46053176 1.71271757 -0.32288518 0.40348318 0.12362186 Ni 0.03190666 5.24888719 1.77350174 -0.15368287 -0.18001232 -0.39304747 Ni 3.45530247 3.46947751 0.00218081 0.37816653 0.06348224 0.06190597 Ni 5.24732664 5.18796290 0.02304317 -0.12782873 0.12072576 -0.02137603 Ni 5.28002728 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6.96167807 0.01407508 -0.16897627 -0.09693714 0.11847277 Ni 5.20767228 8.72120987 0.02618815 0.11614848 -0.19207368 -0.07826917 Ni 5.25436184 6.93473506 1.74669079 -0.34075043 0.28856318 -0.23829013 Ni 3.48344230 8.72208986 1.74496030 0.14107574 -0.28134928 -0.13916965 Ni 6.96556375 6.97304514 0.04529283 0.06616542 0.04215653 -0.16395050 Ni 8.70809252 8.73465061 0.00154524 -0.03105567 -0.30758372 0.18650270 Ni 8.71863827 6.97275375 1.76608065 -0.11702807 0.22493512 -0.56528326 Ni 6.94224236 8.70076569 1.75549502 0.27509207 -0.10194508 -0.46710571 Ni 10.45371007 6.95833727 0.02759709 0.25736643 0.18957072 -0.10501016 Ni 12.18792323 8.72689307 0.00032876 -0.14059110 -0.17148340 0.18215673 Ni 12.17642103 6.99223237 1.74691537 0.26582347 -0.28566307 -0.39527452 Ni 10.48672519 8.68301833 1.74472761 -0.09833303 0.16957932 -0.27576528 Ni 0.05058732 10.46774637 0.03280092 0.04550327 -0.08038574 0.05746642 Ni 1.75519430 12.18897268 0.04591825 -0.02396436 -0.01404142 -0.01396680 Ni 1.74259980 10.47404159 1.76554776 -0.20353856 -0.15486863 -0.18114259 Ni 0.01740269 12.20599925 1.72384834 0.09932456 -0.18710631 0.11896926 Ni 3.50670007 10.48317351 0.04897401 -0.30033629 -0.10718425 -0.16027087 Ni 5.19380709 12.15082357 0.01998106 0.13361863 0.06120099 0.14983988 Ni 5.25879917 10.42558067 1.70933292 -0.41452019 0.47764856 0.34744828 Ni 3.46462994 12.20561739 1.74664220 0.31718152 -0.00393487 -0.05550318 Ni 6.95074821 10.44740434 0.03231209 0.23487335 0.26046040 -0.21115837 Ni 8.72455518 12.22459263 0.01344835 -0.12958589 -0.44409941 0.31202799 Ni 8.69014783 10.41987858 1.74908638 0.22260256 0.39340211 -0.54593245 Ni 6.94156147 12.16334305 1.77558668 0.19196406 0.27660441 -0.65727137 Ni 10.47622733 10.42071225 0.04159394 -0.13545022 0.27845552 -0.26564441 Ni 12.16286285 12.19508705 0.01686253 -0.08069008 -0.15811460 0.08944897 Ni 12.17944851 10.43582831 1.74189497 0.21849867 0.21602960 -0.08499485 Ni 10.44197354 12.16564040 1.70860439 0.14210991 0.13227036 0.12468519 Ni 0.00748850 0.02858285 3.49825060 0.25590799 0.24462438 -0.12583098 Ni 1.76845822 1.76287897 3.46665608 -0.46519419 -0.24352410 0.29599079 Ni 1.76641089 0.00389350 5.18171156 -0.20152888 0.06286024 0.18868106 Ni 0.03253526 1.71407960 5.25291864 -0.12447278 -0.09296620 -0.38711498 Ni 3.51027011 0.03423626 3.47229613 -0.14714901 -0.14545748 0.18450922 Ni 5.19351834 1.75903251 3.45961165 0.58361141 -0.45030136 0.30746431 Ni 5.24136236 0.04767484 5.20936097 -0.19734045 -0.08525380 0.03675354 Ni 3.51492140 1.77013938 5.19528100 -0.24273113 -0.54627260 0.34105640 Ni 6.98275640 0.00071314 3.51604450 0.02219168 0.22949102 -0.10734249 Ni 8.72897463 1.74364604 3.46070723 -0.30339470 -0.36353117 0.33213039 Ni 8.73749644 0.01703558 5.23794092 -0.18727881 0.14208696 0.00497499 Ni 6.98122559 1.76156707 5.24291561 -0.07491328 -0.57977273 -0.34109217 Ni 10.46147910 0.02473440 3.50975701 0.21700992 -0.07067220 -0.22588847 Ni 12.22700897 1.76157099 3.49215434 -0.11246494 -0.35342327 -0.15681558 Ni 12.16996899 0.02595267 5.23708547 -0.15171027 0.16920068 0.06036415 Ni 10.48129535 1.75947853 5.17961285 -0.04302523 -0.40237450 0.42577607 Ni 0.00032973 3.48526264 3.48117676 0.25122768 -0.02983630 0.14417723 Ni 1.74935777 5.23757843 3.45799539 -0.41401085 -0.35625311 0.31112204 Ni 1.72771717 3.49203206 5.26005046 -0.24356050 -0.11378514 -0.56093708 Ni 0.04311941 5.23945710 5.22040802 -0.16207834 -0.03955126 -0.13241725 Ni 3.50918685 3.49071440 3.50795876 -0.16368823 0.19145331 -0.29505807 Ni 5.22297179 5.22682043 3.51869394 0.02650950 -0.02599302 -0.34648123 Ni 5.24031892 3.48962382 5.24898072 -0.18159291 0.06202409 -0.10022840 Ni 3.45231775 5.19770750 5.21880518 0.40053081 0.17988585 0.29987135 Ni 6.95767531 3.47705165 3.50676766 0.21762971 0.13528544 -0.25520248 Ni 8.71828225 5.23813603 3.46554572 -0.17699801 -0.21324567 0.30111490 Ni 8.69652863 3.49611186 5.21729279 0.19905824 0.04905997 -0.18286722 Ni 6.94167515 5.23574029 5.19318950 0.32942424 0.15037167 0.32343917 Ni 10.44881706 3.46697140 3.46255631 0.38704261 0.34511774 0.15139458 Ni 12.17223264 5.26027541 3.49969682 0.21689788 -0.32861750 -0.19890362 Ni 12.16294731 3.47311296 5.19570950 0.16033892 0.17856518 0.17456742 Ni 10.48916688 5.25308115 5.20530787 0.00844924 -0.40641016 0.07037550 Ni 0.05652376 7.00292058 3.48055794 -0.16207336 -0.21882572 0.08935735 Ni 1.72934210 8.71860395 3.51494465 -0.03076711 -0.10924392 -0.31187405 Ni 1.75539485 6.96802812 5.25958320 -0.45661455 -0.05125094 -0.19599485 Ni 0.02950448 8.69902293 5.20401474 -0.09900244 0.19113536 0.30773197 Ni 3.45270606 6.93599840 3.48956960 0.43940710 0.37523315 0.00394761 Ni 5.24314228 8.71320922 3.51166342 -0.33101350 0.02293901 -0.06370018 Ni 5.21930694 6.97047407 5.22494363 -0.12687890 -0.19211694 0.09502773 Ni 3.46636583 8.67934649 5.25166752 0.19130614 0.24070986 -0.26192120 Ni 6.96179877 6.98902254 3.48265968 0.11667990 -0.16283167 0.15910006 Ni 8.72342907 8.72435179 3.47529226 -0.17335873 -0.30207490 0.08173807 Ni 8.73141208 6.98384311 5.19695097 -0.36245813 -0.15770227 0.18175917 Ni 6.95033093 8.69994847 5.25780238 0.29664965 0.18877019 -0.32274499 Ni 10.48308287 6.94608623 3.45951421 0.14258183 0.37655647 0.35940166 Ni 12.21838355 8.69134076 3.45040215 -0.11940677 0.08393411 0.39764824 Ni 12.20926414 6.95612843 5.21653498 -0.02303922 0.27062885 0.11491113 Ni 10.44651797 8.68954178 5.20718534 0.80642820 0.15343628 0.05852751 Ni 0.01736220 10.43924518 3.51571973 -0.09211108 0.21572488 -0.36819976 Ni 1.73363335 12.19376259 3.47137329 -0.16809511 0.13607033 0.12798467 Ni 1.75988247 10.48762624 5.19351693 -0.32938002 0.05485096 0.37541554 Ni 0.01049481 12.18133700 5.19718115 0.17180185 -0.15735245 0.13016440 Ni 3.47457067 10.48039294 3.47415921 0.41169804 0.19964709 0.19396435 Ni 5.23858587 12.21637883 3.47528737 -0.21730484 -0.27238427 0.22086246 Ni 5.21493911 10.46756007 5.24058827 0.17173037 0.28807214 -0.29155516 Ni 3.47161333 12.21954549 5.25075991 0.15691348 -0.10669017 -0.31674990 Ni 7.00292561 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0.02420316 8.73831522 -0.00740694 -0.03476145 -0.21122004 Ni 3.48518913 1.74320271 8.73376457 0.07608391 -0.56909163 -0.34043937 Ni 6.93927202 0.03581246 6.93965599 0.23509262 -0.04730947 0.16661793 Ni 8.70936669 1.77687294 6.96802044 -0.07387249 -0.65562139 -0.14138425 Ni 8.68783683 0.01482983 8.68665119 0.01478193 0.03571502 0.16892257 Ni 6.98751730 1.72888227 8.72701943 -0.19582805 -0.27231518 -0.31828807 Ni 10.42825946 0.02462736 7.00378967 0.36933337 -0.10981265 -0.30634225 Ni 12.17154671 1.73094072 6.99308384 0.13859297 -0.12796992 -0.24093371 Ni 12.21392647 0.00588145 8.71208796 -0.29062848 0.16989723 -0.05336691 Ni 10.45053080 1.73042658 8.67916979 0.23921589 -0.21107882 0.36648293 Ni 0.01411747 3.44362668 6.93685122 -0.07441529 0.27940978 0.30161481 Ni 1.71127182 5.19682259 6.95098874 -0.20732890 0.15671935 0.34787256 Ni 1.74746256 3.45293239 8.72266850 -0.62175846 0.40342719 -0.25728848 Ni 0.00549135 5.23880481 8.68076108 0.14112455 -0.16203641 0.08642476 Ni 3.48282164 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6.98603573 0.09801185 0.07789435 -0.19366338 Ni 1.74379145 12.20406558 6.94546306 -0.33667280 -0.12457237 0.11649587 Ni 1.71630650 10.42902290 8.73670675 -0.17368984 0.57104828 -0.33552786 Ni 0.03014422 12.19279900 8.71282624 0.21574237 -0.22521289 0.04781379 Ni 3.49531643 10.45539005 6.94652308 -0.19868183 0.30458628 0.26211801 Ni 5.21045879 12.16626970 6.95308270 0.16938745 0.17622526 0.10619756 Ni 5.25479140 10.47347338 8.67835895 -0.39408746 0.12300404 0.20780799 Ni 3.45263067 12.19286792 8.67499431 0.14294690 -0.13671378 0.07017649 Ni 7.00338144 10.47630540 7.00167595 -0.17639324 0.17468113 -0.52437051 Ni 8.72568808 12.20409215 6.98064631 0.01389513 -0.12837990 -0.11801642 Ni 8.69983533 10.47453349 8.70197905 0.28610704 0.14742785 0.22949948 Ni 6.97648267 12.17129382 8.70813586 -0.05802465 0.13764528 0.16980761 Ni 10.47313906 10.49864956 6.99950324 0.15853890 0.00248477 -0.45905641 Ni 12.17274913 12.21431355 6.98718953 -0.19281704 -0.30866700 -0.18887193 Ni 12.16257936 10.45002835 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6.96589637 6.96733574 10.46609115 0.11785679 -0.13515249 0.09865030 Ni 8.68646795 8.68677082 10.47463002 0.42141206 0.09992730 0.14510707 Ni 8.71308674 6.94199141 12.19286756 0.12801986 0.09287608 -0.12413701 Ni 6.96031994 8.70383805 12.17948848 0.14095648 -0.18342478 0.10775706 Ni 10.45957747 6.96416398 10.42860082 0.16137241 0.10592708 0.44869379 Ni 12.21600443 8.70473940 10.45607124 -0.21724664 -0.03321703 0.22198014 Ni 12.22296948 6.96106455 12.18663919 -0.34090868 0.06148085 -0.20804782 Ni 10.49114177 8.71371679 12.22046117 -0.07894062 -0.14454086 -0.30315717 Ni 0.02143314 10.42672817 10.50158235 -0.18205422 0.29791800 -0.11489256 Ni 1.74556782 12.21063586 10.45709404 -0.09448172 -0.04035026 0.11651600 Ni 1.71685933 10.44795890 12.18389732 0.13319404 0.19493472 0.13201468 Ni 0.02742445 12.21416729 12.19875741 0.15605060 -0.12949207 -0.16615447 Ni 3.45572155 10.46913029 10.41895855 0.30917629 0.13479206 0.43702874 Ni 5.17384831 12.14508875 10.47156445 0.28768737 0.16385425 -0.00716256 Ni 5.25652657 10.42264545 12.16340030 -0.17526655 0.52748652 0.13246585 Ni 3.47828299 12.21858600 12.19772019 -0.04313744 -0.41652933 -0.25308611 Ni 6.97833907 10.42865365 10.44765548 0.00370926 0.55247757 0.24118455 Ni 8.75007116 12.20983279 10.46048703 -0.19501554 -0.14335252 0.17816704 Ni 8.69357586 10.45349756 12.19261379 0.26265165 0.11985759 -0.11429507 Ni 6.99271275 12.17059937 12.17332524 -0.10388439 -0.16297674 -0.26580610 Ni 10.48758075 10.49879223 10.44602069 -0.23528100 -0.39651309 0.35847019 Ni 12.20191066 12.19869193 10.42896193 -0.03925338 -0.10230121 0.27629464 Ni 12.18410667 10.43180909 12.20611020 -0.11363597 0.13712541 -0.18935100 Ni 10.48178115 12.21298667 12.21499785 -0.00808153 -0.30451691 -0.27812462