256 Lattice="13.827068560904236 0.0 0.0 0.0 13.827068560904236 0.0 0.0 0.0 13.827068560904236" Properties=species:S:1:pos:R:3:forces:R:3 energy=-978.4193719861612 stress="-0.009568006163142498 6.456441178867322e-05 -0.00039510770271588094 6.456441178867322e-05 -0.009084351729521545 -0.00012808482185649683 -0.00039510770271588094 -0.00012808482185649683 -0.009405546892668164" free_energy=-978.4193719861612 pbc="F F F" Ni 0.01535411 0.02872389 0.01356356 0.50050492 0.59730346 0.60219524 Ni 1.71743369 1.72233297 0.02445584 0.17109481 0.08277632 -0.28390538 Ni 1.68411647 0.02147028 1.75266585 0.52604913 -0.34548612 -0.23411418 Ni 0.01977442 1.76392156 1.76281000 -0.55792443 -0.15892180 -0.11038433 Ni 3.45921697 0.01788518 0.00895368 -0.24404998 0.11043252 0.21917724 Ni 5.16332729 1.73336191 0.01829409 0.19097624 0.05158010 -0.47690985 Ni 5.19603105 0.00109456 1.70288470 -0.22073010 -0.32291724 0.15821421 Ni 3.45153377 1.70518213 1.70086727 -0.14158420 0.27281125 0.52737016 Ni 6.93242609 0.01199672 0.05290072 -0.05431274 0.09498323 -0.04216500 Ni 8.62138895 1.74001212 0.01098258 0.27020141 -0.09873402 -0.38686662 Ni 8.64230640 0.00689645 1.75162229 0.23892389 -0.31940776 0.07212902 Ni 6.92370333 1.72568602 1.70648410 -0.27131103 0.24822185 0.45674821 Ni 10.33158444 0.02895511 0.02619135 0.08919139 0.29553258 0.24008413 Ni 12.09339839 1.79255957 0.00937204 -0.25295975 -0.13839646 0.30344830 Ni 12.11273062 0.01598272 1.73251361 -0.42416925 0.44659562 0.08829233 Ni 10.39278032 1.71789817 1.70926724 -0.41715916 0.23630622 0.36605368 Ni 0.02094202 3.42231197 0.00547644 0.22392623 0.16401779 0.26887675 Ni 1.70916620 5.21464973 0.01588319 0.17553889 -0.38384462 -0.30491621 Ni 1.69770164 3.44505749 1.75675785 0.48324473 0.14362707 -0.17230567 Ni 0.00032154 5.21112212 1.73083790 -0.42583574 -0.20914057 0.04555096 Ni 3.44183757 3.47830281 0.02818096 -0.33375283 -0.24273063 -0.58561674 Ni 5.15419742 5.21776099 0.00881866 0.42514868 -0.39548650 -0.76297510 Ni 5.16815071 3.48389721 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0.00687860 -0.31792045 0.25531546 -0.52753176 Ni 5.21854573 8.61549139 0.02865977 -0.26383895 0.49556759 -0.33347710 Ni 5.20101069 6.88142062 1.71355543 -0.18513275 0.52231363 0.65117509 Ni 3.42758132 8.62918596 1.74933690 0.67888139 0.17416420 -0.28042482 Ni 6.90707325 6.88442445 0.02672978 0.32035160 0.21057170 -0.71422765 Ni 8.66644175 8.64573055 0.02650069 -0.17807529 0.00599746 -0.47478707 Ni 8.62850496 6.93723010 1.74907410 0.27130313 -0.23972757 -0.27387600 Ni 6.91404631 8.61969131 1.74536472 -0.17333784 0.36665715 -0.09429304 Ni 10.35645112 6.88413152 0.02615376 0.09459265 0.10349911 -0.43456059 Ni 12.11658242 8.62800286 0.01453892 -0.48615065 0.20266574 0.44234631 Ni 12.06852680 6.88614566 1.72087801 0.62128859 0.10053440 0.03306015 Ni 10.38214423 8.60812022 1.75294685 0.01774943 0.58475810 -0.29220589 Ni 0.00939565 10.40072356 0.03057318 0.43863049 -0.18959736 0.35931017 Ni 1.74601648 12.11937033 0.03391099 0.04152807 -0.40100822 0.32607406 Ni 1.76070531 10.34593705 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0.00726219 3.44444936 -0.25405528 0.13806545 0.17960337 Ni 1.70520017 1.70459300 3.47439407 0.30958741 0.42232258 -0.28037055 Ni 1.70589453 0.02695484 5.19179873 0.28298053 -0.41224606 0.22130237 Ni 0.01685911 1.78390631 5.21496642 -0.51932247 -0.50315768 -0.32782485 Ni 3.47118674 0.03190931 3.47401855 -0.26396175 -0.61679371 -0.32314962 Ni 5.20295401 1.69675452 3.47917624 -0.27231633 0.58615840 -0.60240851 Ni 5.17984437 0.00034066 5.19461609 -0.09621043 -0.47673505 -0.02433753 Ni 3.42891746 1.74445359 5.16383874 0.18969612 -0.25306201 0.58430501 Ni 6.88108337 0.00420160 3.41803153 0.19808565 -0.63147796 0.11198455 Ni 8.62502706 1.71488314 3.47027532 0.33598305 0.42629338 -0.41467947 Ni 8.64362763 0.02414190 5.15325144 0.05093371 -0.57204104 0.31590927 Ni 6.89800211 1.70667868 5.16667615 -0.01536646 0.29096990 0.28864922 Ni 10.39317761 0.02886868 3.48192129 -0.08748121 -0.49896584 -0.35047575 Ni 12.06452601 1.74302004 3.48924674 0.81134701 -0.18677196 -0.32635816 Ni 12.11584388 0.00760944 5.19214674 -0.26922335 0.18158271 0.04996596 Ni 10.38085641 1.72057407 5.18359812 -0.36837785 0.19108632 0.32426251 Ni 0.00929354 3.48256831 3.48054289 -0.44924189 -0.04533307 -0.12023284 Ni 1.73218209 5.21912194 3.40291405 0.12541835 -0.34945750 0.48268438 Ni 1.74415358 3.44307361 5.18702736 -0.15473551 0.33086731 -0.22837431 Ni 0.00979734 5.21716298 5.16236838 -0.16099497 -0.08047098 0.25477472 Ni 3.45530159 3.42247754 3.46376741 -0.03635414 0.24891685 -0.44376770 Ni 5.20709669 5.16403683 3.43473102 -0.26794555 0.18728739 0.24181508 Ni 5.16648497 3.46403421 5.20669699 0.15514087 -0.26260052 -0.04880068 Ni 3.43924401 5.18850646 5.17296265 0.10911815 0.05308584 -0.10477723 Ni 6.90571732 3.43693873 3.47986444 0.00985999 0.14591936 -0.32966474 Ni 8.62608662 5.21768296 3.43060558 0.17901528 -0.57536819 0.35476478 Ni 8.61869760 3.46927827 5.20812190 0.34145167 -0.11911464 -0.49441085 Ni 6.89614991 5.20957593 5.20349311 0.26279330 -0.32875732 -0.21880324 Ni 10.39822835 3.42301384 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10.39684883 -0.18373611 -0.29779552 -0.40568205 Ni 8.61012233 8.65394966 10.34161136 0.45674899 0.17695859 0.52987423 Ni 8.61023495 6.88383505 12.11701966 0.53130513 0.32397610 0.21015961 Ni 6.90308530 8.62333954 12.10575591 0.17839601 0.36177448 0.39727830 Ni 10.35844945 6.91471017 10.36183979 -0.22485569 -0.26223004 0.17179210 Ni 12.08857103 8.62316497 10.36012651 0.26399879 0.45641209 -0.11503286 Ni 12.10266241 6.92815138 12.06663706 -0.30032116 -0.20724484 -0.18756072 Ni 10.40470759 8.64188522 12.07280204 -0.37032196 -0.07606323 0.19513842 Ni 0.01596425 10.41216796 10.39214019 -0.38332795 -0.23200316 0.00668204 Ni 1.76779536 12.09119949 10.34403646 -0.18063441 0.44812214 0.27133229 Ni 1.71257346 10.36456390 12.08726372 0.14352798 0.13209424 0.33744318 Ni 0.01834437 12.12723213 12.10261788 0.73218083 -0.64855249 -0.71394021 Ni 3.42604485 10.39579183 10.36732331 0.47730725 -0.27269311 0.12207559 Ni 5.22405882 12.12585136 10.37158426 -0.25117181 0.20522541 -0.01318377 Ni 5.20645863 10.37718680 12.10233509 -0.31079690 -0.18281742 0.13189719 Ni 3.46831285 12.06821480 12.09022355 -0.05775955 -0.19609711 -0.22830907 Ni 6.89254696 10.40369622 10.39332531 0.32625332 -0.31808868 -0.32244027 Ni 8.63764260 12.07855119 10.34514585 0.07978624 0.38824732 0.31062032 Ni 8.69989049 10.33501125 12.09840032 -0.32939301 0.16650541 0.15837597 Ni 6.89858623 12.07804678 12.11277777 0.31989967 -0.22566738 -0.20679388 Ni 10.36749088 10.40973013 10.36856833 0.26420256 -0.28940782 -0.24122892 Ni 12.10354347 12.12250180 10.39584400 -0.57940062 -0.53345867 -0.26087458 Ni 12.08984894 10.36601358 12.10533851 -0.43452930 -0.04720542 -0.49623509 Ni 10.35474785 12.12415907 12.12960970 -0.11092774 -0.50919757 -0.55908166