108 Lattice="10.985065541262255 0.0 0.0 0.0 10.985065541262255 0.0 0.0 0.0 10.985065541262255" Properties=species:S:1:pos:R:3:forces:R:3 energy=-262.62669925206103 stress="-0.006706277670565652 0.00028170436493761043 0.0008698696880980212 0.00028170436493761043 -0.007313519829406857 -0.00037524049581546295 0.0008698696880980212 -0.00037524049581546295 -0.006221873305951549" free_energy=-262.62669925206103 pbc="F F F" Ni 0.02464339 0.01440597 0.03625565 -0.37746964 -0.46513271 -0.52472412 Ni 1.80613093 1.86025193 0.03568178 1.15341391 0.47983655 -0.82111766 Ni 1.81152571 0.01819084 1.83418940 0.99817549 -0.68561074 0.62566476 Ni 0.02921020 1.81464971 1.79652181 -0.99722624 0.92841492 1.06207096 Ni 3.62793925 0.00472748 0.00591888 -0.00080623 -0.19953320 -0.31964207 Ni 5.46011952 1.86038738 0.00279000 0.24453367 0.32377945 -0.60662094 Ni 5.47685667 0.03178234 1.80001765 -0.01974599 -0.67622935 0.76742461 Ni 3.68741123 1.84222183 1.86400208 -0.32810205 0.67207485 0.21637135 Ni 7.32832784 0.00123016 0.03212760 -0.53809955 -0.37347781 -0.38179664 Ni 9.13494290 1.79503202 0.02125439 0.39078474 0.79456508 -0.46513333 Ni 9.18888932 0.03311950 1.83882199 0.27186746 -0.42118599 0.61716541 Ni 7.29141227 1.86589172 1.85244015 -0.26751483 0.28126640 0.43831735 Ni 0.02879281 3.68212628 0.00087560 -0.71193587 -0.03616772 -0.42699717 Ni 1.79694436 5.47712749 0.02329923 0.91417481 0.08214027 -0.66193931 Ni 1.80566927 3.65489685 1.83817055 1.18779992 0.25563872 0.80575975 Ni 0.02918740 5.49335366 1.84543444 -0.86047391 -0.08952818 0.46797212 Ni 3.69528869 3.69090561 0.03258060 -0.42112122 -0.06841931 -0.29465282 Ni 5.50676410 5.47999224 0.01934832 -0.00355466 0.27311084 -0.33809250 Ni 5.52337068 3.64452090 1.83223440 -0.33117543 0.41989572 0.98870386 Ni 3.65173486 5.52523852 1.81373878 0.28087625 -0.46007508 0.99327893 Ni 7.33141665 3.69391088 0.03234169 -0.41804415 -0.24494839 -0.67292643 Ni 9.17048539 5.50211985 0.02955902 0.30708731 0.01678321 -0.36988487 Ni 9.14416236 3.67140304 1.84437155 0.55049065 -0.02578857 0.44864970 Ni 7.30365860 5.50679422 1.83341846 -0.30009821 -0.03072653 0.84605148 Ni 0.02885111 7.34949021 0.02267044 -0.66229152 -0.76503978 -0.63090188 Ni 1.83164998 9.11889850 0.00220365 0.52988090 0.56107553 -0.54662863 Ni 1.83220193 7.29487859 1.83431038 0.70992461 -0.40700713 0.49460412 Ni 0.00629996 9.11782988 1.81477934 -0.44087609 0.69164708 0.57742617 Ni 3.66956280 7.29344774 0.00221698 0.10714143 -0.40655790 -0.57002140 Ni 5.52061587 9.15546926 0.00875825 -0.30317086 0.32978628 -0.35501169 Ni 5.50355475 7.35114073 1.85563764 -0.30937496 -0.75635720 0.41716444 Ni 3.62887253 9.11862575 1.80921487 0.45783539 0.56035082 0.66029197 Ni 7.33295557 7.34861687 0.02374019 -0.72332312 -0.94100971 -0.85338707 Ni 9.15481076 9.13491856 0.01970719 0.45369669 0.45520158 -0.52123933 Ni 9.12820926 7.35415503 1.80864293 0.84455249 -0.96070987 0.93883852 Ni 7.35212022 9.15144167 1.79786614 -0.79684074 0.94774327 0.92433754 Ni 0.00723025 0.00183196 3.63261253 -0.23468922 -0.28419014 0.22065848 Ni 1.86029091 1.85868232 3.63767152 0.25307244 0.47046624 0.20687705 Ni 1.85021124 0.00863995 5.51892473 0.20650770 -0.49655946 -0.19038088 Ni 0.00603691 1.80596891 5.47489121 -0.36087992 0.55963315 -0.02860537 Ni 3.63992331 0.02752444 3.68453805 0.19297672 -0.69568724 -0.20846313 Ni 5.48662875 1.79720564 3.64911053 0.00079131 1.23570794 0.31459317 Ni 5.53777855 0.01970174 5.47444359 -0.37790558 -0.53598410 0.12565405 Ni 3.63192429 1.81477356 5.46403985 0.49466601 1.14307284 0.13184752 Ni 7.32849324 0.03308571 3.66393738 -0.44800325 -0.73372833 -0.36135937 Ni 9.13365500 1.85033001 3.68216893 0.69124268 0.48075071 -0.19189846 Ni 9.15567482 0.02134606 5.48531724 0.32332463 -0.37140204 0.14407606 Ni 7.31893009 1.82168581 5.46430339 -0.68539506 0.92638880 0.37181919 Ni 0.01564787 3.67029642 3.68710384 -0.44941083 -0.12520426 -0.19140528 Ni 1.82149460 5.51820656 3.63858145 1.04373520 -0.52935243 0.46372009 Ni 1.83104359 3.64114772 5.48078911 0.93585562 0.55749149 0.00487252 Ni 0.00101239 5.50446968 5.48252246 -0.17936096 -0.14005573 0.15329813 Ni 3.69411361 3.67203672 3.63247743 -0.08440617 0.38257394 0.38682546 Ni 5.50888742 5.50732895 3.63111392 -0.33004778 -0.23333655 0.43651471 Ni 5.51664530 3.63788487 5.49475198 -0.25087546 0.44046742 -0.34846606 Ni 3.64748251 5.51782765 5.51003035 0.24711565 -0.53360005 -0.44200427 Ni 7.35933338 3.67017615 3.66390865 -1.18180438 0.26113852 0.23799192 Ni 9.18592545 5.49617555 3.68445329 0.10828133 0.06806160 -0.13039778 Ni 9.14027742 3.63399382 5.52597136 0.42549921 0.43875562 -0.28186271 Ni 7.31488615 5.52755335 5.49036393 -0.61566950 -0.45287428 -0.14545026 Ni 0.01894915 7.32928959 3.63777883 -0.59430369 -0.43169900 0.37281266 Ni 1.84885433 9.13398152 3.64169627 0.31577983 0.58246854 0.18156019 Ni 1.83442853 7.31795908 5.49710546 0.51048589 -0.75319917 -0.09667351 Ni 0.03119349 9.16601366 5.51450127 -0.32887156 0.26534125 -0.20252372 Ni 3.63405666 7.32308336 3.65622282 0.60422867 -0.73024358 0.24928216 Ni 5.52348020 9.15763618 3.69233114 -0.50183893 0.34205783 -0.18959719 Ni 5.51226440 7.30195483 5.50620473 -0.38958335 -0.48007528 -0.44443549 Ni 3.63678613 9.12988361 5.50953137 0.44513788 0.42429079 -0.37861241 Ni 7.31429419 7.34989796 3.63061271 -0.34641334 -0.97820492 0.35512371 Ni 9.15623258 9.15062642 3.66342521 0.28948822 0.26257214 0.19358825 Ni 9.12530423 7.29105432 5.52580263 0.53344256 -0.26512250 -0.23133863 Ni 7.30698832 9.12090820 5.50565672 -0.28921352 0.63084517 -0.06457465 Ni 0.00375676 0.01140143 7.33885471 -0.31329880 -0.32201798 -0.37037780 Ni 1.85267541 1.86128502 7.31820727 0.65940037 0.45325813 -0.52429635 Ni 1.86083142 0.03089573 9.15648408 0.26960435 -0.59476220 0.31749216 Ni 0.02400245 1.83728729 9.17645977 -0.35055123 0.41158370 0.41983371 Ni 3.69165838 0.02187487 7.31772253 -0.04670946 -0.51758215 -0.54541665 Ni 5.46657643 1.83427291 7.28982236 0.27732759 0.77537485 -0.33002311 Ni 5.47147302 0.02910317 9.17235570 0.11447043 -0.24253788 0.33242597 Ni 3.63373315 1.82517532 9.18755623 0.14463784 0.78038802 0.26667920 Ni 7.32620100 0.03261680 7.35933005 -0.55508988 -0.56178421 -0.66926265 Ni 9.13190822 1.85947801 7.33168755 0.66744391 0.14965335 -0.54135947 Ni 9.15393324 0.01916732 9.17629098 0.24087007 -0.16210971 0.18300480 Ni 7.33851820 1.85926889 9.16481291 -0.77347993 0.44748503 0.48872623 Ni 0.02597924 3.62880835 7.33010525 -0.55268863 0.30282294 -0.71916382 Ni 1.83854272 5.50418222 7.35905814 0.82206813 -0.23589060 -1.25812932 Ni 1.83663976 3.69685834 9.15177785 0.61650365 -0.30837238 0.50930226 Ni 0.02984453 5.49436832 9.14266619 -0.69998543 -0.12230800 0.44952636 Ni 3.69560610 3.67816038 7.31788522 -0.24040324 -0.02836892 -0.81334138 Ni 5.50817254 5.51489195 7.33149693 -0.07073077 -0.52742411 -0.60074252 Ni 5.46278672 3.61602194 9.16612420 0.33960476 0.29481645 0.14932279 Ni 3.67028487 5.45800324 9.18794876 0.17048558 0.34844946 0.15965706 Ni 7.35216080 3.69119515 7.31600604 -1.42475514 -0.17498705 -0.61869800 Ni 9.15537578 5.47978362 7.35308788 0.43756518 0.34877853 -0.70614778 Ni 9.14628594 3.67278949 9.13358308 0.58074783 -0.05582630 0.63064167 Ni 7.34557571 5.48822540 9.17128039 -0.88644569 0.07879674 0.40984762 Ni 0.01851012 7.31792019 7.32300422 -0.61343945 -0.42184071 -0.57510601 Ni 1.86668783 9.15091623 7.31004953 0.28950297 0.45258832 -0.24441938 Ni 1.81784516 7.29913084 9.16307312 0.96800448 -0.27054547 0.48975786 Ni 0.03055267 9.13868635 9.14074871 -0.21396788 0.29001036 0.20024591 Ni 3.69324039 7.32508370 7.29426801 -0.29237082 -0.79873987 -0.07678449 Ni 5.48345374 9.16701832 7.33885369 -0.15950661 0.58189490 -0.67797171 Ni 5.47995537 7.33107007 9.12923841 -0.10364019 -0.58042110 0.69016745 Ni 3.63309563 9.17304870 9.16114349 0.08358007 0.15099376 0.30879684 Ni 7.29661836 7.35600753 7.33245395 -0.35967806 -1.18327628 -0.45510146 Ni 9.13526000 9.12597884 7.34456563 0.58143354 0.58913157 -0.62097521 Ni 9.15724633 7.35556084 9.17884620 0.36915703 -0.66569954 0.36928468 Ni 7.32448329 9.14859098 9.14297571 -0.53961610 0.55709804 0.62016319