1372 Lattice="24.282691211770004 0.0 0.0 0.0 24.282691211770004 0.0 0.0 0.0 24.282691211770004" Properties=species:S:1:pos:R:3:forces:R:3 energy=-5408.508120861335 stress="-123.79808649791156 0.04688753672460422 -19.19717786837711 0.04688753672460422 -119.34396625093333 -2.2142017087161037 -19.19717786837711 -2.2142017087161037 -115.70912016341822" pbc="F F F" Ni 0.00825226 0.02500391 0.01760286 0.62395082 0.27306270 0.64768215 Ni 1.71126983 1.70194702 -0.02159870 0.16060215 0.16189352 0.42932083 Fe 1.75786623 -0.02738852 1.75771543 -0.34840505 0.17854162 -0.58611006 Ni -0.02763585 1.72239907 1.71476516 0.60385527 0.05724334 0.48846174 Fe 3.49362669 0.01860811 -0.01068815 -0.20681941 0.10567033 0.06509460 Fe 5.19356941 1.74614674 0.00836875 -0.19879107 -0.01708600 -0.11134691 Ni 5.15883917 0.00110873 1.75654692 0.45809167 -0.16594258 -0.20127608 Ni 3.47568035 1.73833648 1.75616601 -0.46224853 0.37740737 -0.26395609 Fe 6.89267260 -0.02263728 0.02567974 -0.01513941 0.01092918 0.35113022 Fe 8.64306024 1.76436404 0.00174261 0.36023339 -1.00983864 -0.27874537 Ni 8.64461511 0.00466354 1.73577399 0.38154965 0.02272240 -0.32312739 Ni 6.92646072 1.75785171 1.72253505 -0.16975411 -0.19444119 0.30418589 Ni 10.40033950 -0.02369933 -0.00442026 0.09944492 0.97495950 0.66341519 Fe 12.15775419 1.70404724 0.03395132 -0.52434718 -0.51789832 -0.65218994 Ni 12.14887962 -0.01779343 1.75150668 -0.15417791 -0.21390590 -0.29214616 Fe 10.41574244 1.70537360 1.75586241 -0.22812864 -0.57227152 -0.62343946 Ni 13.84393077 0.02111478 -0.02156277 0.30905764 0.31290942 0.74521783 Ni 15.57628220 1.74549092 -0.01697488 0.30920029 -0.31499305 0.62836541 Fe 15.63872979 -0.00631060 1.73275051 -0.36950505 0.23358768 -0.46007410 Fe 13.84705413 1.72643394 1.76678358 0.44400595 -0.40625133 -0.15473782 Fe 17.36761265 -0.00788003 0.00403216 -0.06913832 0.48527393 -0.07961332 Ni 19.10508500 1.72548474 0.00489392 -0.22105284 -0.04292479 -0.02025307 Fe 19.08293185 -0.01710037 1.74050415 0.56736831 -0.23956989 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0.22662004 Ni 8.68550339 8.68026309 -0.01734881 -0.22312567 0.28385572 0.21477530 Ni 8.66021211 6.91217783 1.76339773 0.35024406 1.06543911 -0.24523958 Fe 6.95807392 8.65653631 1.74569118 0.40778512 -0.11166942 -0.30730486 Ni 10.39142442 6.91428997 -0.01192120 0.54082250 0.44959250 0.24409027 Fe 12.12028834 8.69379857 -0.01750171 0.08533380 -0.38776667 -0.49867055 Fe 12.17870698 6.95890326 1.67927101 -0.54941057 -0.79919353 0.31232602 Fe 10.38933098 8.69336285 1.70294095 -0.29998969 -0.56716905 -0.04625976 Ni 13.85000632 6.97192210 -0.02251694 0.34182011 -0.28602844 -0.41946952 Ni 15.61939783 8.65031313 0.00054830 -0.08048621 0.31408469 0.00572470 Ni 15.61116005 6.91187324 1.71342469 0.09295065 0.18740393 0.21164624 Ni 13.86179330 8.65230771 1.73691087 0.13213589 0.49038857 -0.13853247 Ni 17.35581044 6.95469156 0.00652798 0.21356988 -0.41250079 -0.27902065 Fe 19.11078382 8.65426762 0.01128209 -0.48257014 0.46577604 -0.25480150 Fe 19.06248072 6.95337788 1.71422252 0.35047652 0.29564772 0.71951628 Ni 17.34410312 8.70491603 1.73158305 0.01952844 -0.66198577 -0.18971348 Ni 20.79467221 6.96399313 -0.00209606 0.38229014 -0.61459106 0.20217613 Ni 22.57100710 8.64439529 -0.02816839 -0.53729832 0.44591926 0.54056170 Ni 22.57853257 6.92751030 1.71186104 -0.18464948 0.00524495 0.34925388 Ni 20.84834608 8.70299162 1.71676744 -0.23649499 -0.57987650 0.21157000 Ni 0.05017559 10.39463334 0.03165151 -0.21033930 -0.04121218 0.14255214 Ni 1.73074646 12.15858373 0.01977732 -0.00843289 -0.07464088 -0.24653975 Ni 1.74805918 10.36767850 1.71668531 -0.49704795 0.32723573 0.27789215 Ni -0.02898330 12.11762203 1.73210253 0.28252558 0.33048365 0.35456389 Fe 3.45337757 10.42671973 0.01387694 -0.11248292 0.60321306 -0.55209598 Ni 5.19895032 12.16523030 -0.02197863 0.07104563 -0.19059003 0.24332952 Fe 5.17542308 10.42827717 1.70055802 0.29275983 0.03964437 0.37778593 Ni 3.48176840 12.16694050 1.75202300 -0.33299530 -0.20858548 -0.48039281 Fe 6.91421891 10.39780836 0.00111880 0.80572507 0.46510497 -0.40604576 Ni 8.69861719 12.17127839 0.02244867 -0.24630858 -0.27135038 -0.30919641 Ni 8.69458563 10.43986335 1.75826836 -0.66831427 -1.18354988 -0.68974670 Fe 6.98123863 12.13916430 1.73425821 -0.51592493 0.24495485 -0.52195344 Fe 10.42035780 10.44045432 -0.02201821 -0.58746044 0.23055862 -0.24890173 Ni 12.15995633 12.12031290 0.00449885 -0.19379813 0.11120011 -0.25191848 Fe 12.13173423 10.40398833 1.74387627 0.48775149 0.46846098 0.30018466 Ni 10.37719054 12.12810560 1.75707982 0.63362498 0.60017879 -0.26237247 Ni 13.85699642 10.35372480 -0.00975441 0.24476172 0.29346175 0.15416593 Fe 15.58514732 12.08605063 -0.02039848 0.40366515 0.12574369 -0.18557530 Ni 15.61829539 10.42482461 1.75205675 -0.34342176 0.01230222 -0.24626684 Fe 13.86526777 12.16650409 1.70615221 0.30087590 -0.75360823 0.75434265 Ni 17.37579604 10.38149804 0.00121748 -0.24784595 0.43466366 -0.14198193 Ni 19.08269043 12.16420766 -0.02906313 0.19106703 -0.26622547 0.35222216 Ni 19.08292154 10.37580523 1.75196688 0.27799492 0.68763396 -0.34421443 Fe 17.33357354 12.15239576 1.76161790 0.07463228 -0.19443706 -0.80764391 Fe 20.85797895 10.43395714 0.02947527 -0.55551411 -0.36700163 -0.48202562 Ni 22.51524076 12.12251285 -0.01722780 -0.03755138 0.34744729 0.51045367 Fe 22.51717127 10.43292759 1.75271528 0.80913302 0.27899054 -0.32709622 Ni 20.79213767 12.15814131 1.72217216 0.50720776 -0.18845606 0.36033411 Fe -0.03280323 13.88420252 0.02298148 0.22115471 -0.35148534 -0.01453180 Ni 1.74866884 15.57749488 -0.02816973 -0.35505261 0.27173023 0.15382664 Fe 1.75681503 13.85615583 1.70597542 -0.23256304 -0.03713542 0.97751383 Fe -0.00065593 15.61332588 1.73213557 -0.17067345 -0.02493790 0.27864590 Fe 3.45458968 13.87904582 -0.02561097 0.43265716 -0.32678267 -0.47347808 Ni 5.23794891 15.63206047 -0.02010276 -1.03350127 -0.60896351 0.11548995 Fe 5.18163623 13.85507511 1.75013960 0.55921573 0.37433442 -0.78285472 Fe 3.44470050 15.61856491 1.69990043 0.29897307 -0.40442356 0.21010988 Ni 6.94696268 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12.15754541 -0.38575002 -0.25913193 -0.54549014 Ni 3.46849294 6.94341632 10.42546454 -0.45218469 0.04059969 -0.35445084 Fe 5.19043839 8.67347038 10.43125061 -0.26024808 -0.48733851 -0.50114751 Ni 5.17656245 6.93909003 12.13383523 0.93056262 0.27740714 0.57765256 Fe 3.48489163 8.67499196 12.12476357 -0.36587877 -0.68123937 0.46228558 Fe 6.88267504 6.96517360 10.38688971 0.60053327 -0.76437997 0.29367025 Fe 8.64584435 8.64357959 10.38111154 0.59287706 0.82097108 0.61351969 Fe 8.65497103 6.90803492 12.11096526 0.78733621 0.12202946 0.32476633 Fe 6.92868771 8.69378576 12.15036661 0.14054002 -0.00725583 -0.19962878 Fe 10.42584439 6.91918610 10.41428468 -0.10860805 -0.29719577 0.12326708 Fe 12.16412990 8.68680927 10.46361073 -0.31488694 -0.31047949 -0.26523232 Ni 12.13219484 6.96233607 12.15290014 0.41230049 -0.52959087 -0.35125592 Ni 10.38972709 8.67034337 12.13065485 -0.43145925 -0.19169527 0.14272689 Ni 13.87869403 6.94437980 10.38330854 -0.26710321 -0.22700587 0.45254558 Ni 15.61089487 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10.39112968 -0.95284687 -0.63209541 0.22676656 Ni 1.69979259 17.35413215 12.11600990 0.82000610 0.22290049 0.35913754 Ni -0.02613687 19.10897181 12.11934767 0.15738092 -0.30112628 -0.01971884 Ni 3.45696964 17.36170335 10.37668697 0.34992285 -0.28114366 0.43193367 Ni 5.23621816 19.05520478 10.37289327 -0.57052504 0.35264434 0.54562149 Ni 5.23673407 17.35482323 12.17171156 -0.64140067 -0.41109583 -0.31599610 Fe 3.49615309 19.10907894 12.11156458 -0.14885050 -1.10070579 0.27409304 Fe 6.91512648 17.36495060 10.41536308 0.88520682 -0.53054347 -0.28182843 Ni 8.65558505 19.07073932 10.43664437 0.32019886 0.29940550 -0.68193136 Ni 8.66182872 17.35931741 12.13440395 0.03763252 -0.44431785 0.28806250 Fe 6.94868938 19.08262880 12.11577423 -0.63219620 -0.18928873 0.45830949 Ni 10.38703663 17.37405472 10.37403945 0.27729358 -0.21813857 0.23467639 Fe 12.11920089 19.09682701 10.40445069 0.06186477 -0.54887118 0.15113922 Ni 12.11040456 17.35908280 12.14839040 0.43058675 -0.43665574 -0.35699089 Ni 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0.30465206 0.33945304 0.26695044 Ni 1.75883061 22.52244557 10.38808141 -0.28766226 0.34383876 0.63363734 Fe 1.71176806 20.80135026 12.15195077 0.06242791 0.35349747 -0.47038972 Ni -0.00375926 22.57376021 12.11091949 0.79332815 -0.72895493 0.22501049 Ni 3.46551026 20.79303467 10.39273214 0.18434351 0.16946445 0.32872606 Fe 5.16983182 22.52161671 10.38013810 0.45831458 0.36199511 0.29386868 Fe 5.17742600 20.79866220 12.11595890 0.38587617 -0.31354833 -0.30918498 Ni 3.46994576 22.52190507 12.17498637 -0.24192393 0.23453484 -0.61448611 Ni 6.96525179 20.78753000 10.40737670 -0.40441488 0.38170761 0.32368298 Ni 8.64043479 22.53857779 10.43500068 0.60281480 0.03887384 -0.28277535 Fe 8.66205450 20.82715604 12.17383095 0.75996357 -0.65272037 -0.80373140 Fe 6.94089103 22.51788855 12.12066962 -0.30635402 0.55262533 -0.16671979 Ni 10.41586314 20.79925716 10.40425049 -0.40432407 0.09975196 0.47381643 Ni 12.10721265 22.55136014 10.39339539 0.35830753 -0.11620600 0.03834478 Fe 12.17186906 20.83585381 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20.79774643 0.41321008 -0.50061035 0.15128767 Fe 5.23318348 8.63929449 20.84077113 -0.42495084 0.67676979 -0.82750212 Ni 5.17127715 6.96857288 22.52771712 0.53332046 -0.76784305 0.43974867 Ni 3.50024555 8.67080297 22.57436695 -0.50260952 0.13602739 -0.10148081 Ni 6.91993396 6.90690923 20.82209357 0.03171290 0.31737619 -0.16083332 Fe 8.69258166 8.69874860 20.78355743 -0.52568965 -0.30486789 -0.39488347 Fe 8.64910018 6.92234211 22.51855036 0.33689445 -0.12218390 0.34328342 Fe 6.97214045 8.63959013 22.55129929 -0.58287191 0.15880281 0.34693426 Fe 10.41578729 6.96197598 20.76288602 -0.24807021 -0.95213705 0.46455103 Fe 12.12389941 8.67942554 20.85045244 0.78774558 -0.31502945 -0.35782355 Ni 12.14020786 6.92282587 22.51507995 -0.25085501 -0.13901529 0.26802781 Fe 10.44594911 8.64522630 22.57767581 -0.42924509 0.14336611 0.45878879 Ni 13.88105169 6.95317850 20.82258332 -0.33461579 -0.16315083 -0.51678990 Fe 15.60695384 8.69440726 20.79033113 -0.22497167 -0.44204169 0.46130588 Fe 15.58259509 6.94241790 22.56550144 0.45912632 0.30664951 0.19965940 Ni 13.88270044 8.66646315 22.56305777 -0.13108745 0.26024650 -0.21535895 Ni 17.36955001 6.95713363 20.83059430 -0.80998156 -0.48966220 -0.37474754 Fe 19.06675813 8.66796729 20.83825924 0.40810836 0.27307159 -0.22362153 Fe 19.06768864 6.95891725 22.56895282 0.23581958 -0.56747230 0.19271532 Ni 17.32875183 8.67686190 22.51411859 -0.16996342 -0.21591402 0.54877736 Ni 20.82083679 6.90366283 20.78299453 -0.57181268 0.42203962 0.17157565 Ni 22.53023212 8.67203418 20.84070637 0.07970772 -0.11407511 -0.47908640 Ni 22.56481769 6.96751058 22.57082298 -0.49018252 -0.16732334 -0.70927987 Fe 20.79556693 8.63279071 22.51771677 0.21699842 0.14771137 0.29091780 Fe 0.00107274 10.43109918 20.84128033 -0.25384415 -0.35151499 -0.14477496 Ni 1.72006813 12.15465208 20.83466244 0.38972243 -0.06543750 -0.48278524 Ni 1.70715461 10.37988383 22.52611795 0.53075068 0.14284229 0.48427658 Ni 0.02322517 12.11724660 22.56281246 0.29474773 0.31701961 -0.18242693 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0.48709457 0.50786838 Ni 15.61564439 10.37887754 22.55086907 0.16020133 0.31229796 -0.21885121 Ni 13.87881448 12.13203994 22.53943847 -0.03314466 0.21988593 0.23538941 Fe 17.35045358 10.37626387 20.80540105 -0.40233570 0.69344678 0.02802505 Fe 19.09922248 12.11402602 20.80724384 -0.31898045 0.33742414 -0.29570116 Ni 19.04469714 10.43385654 22.54119177 0.24889633 -0.69916267 0.25426414 Fe 17.37818444 12.13507659 22.54183533 -0.65513183 0.20589272 0.16543554 Ni 20.78195889 10.41531941 20.83969372 0.55186487 -0.70505971 -0.43810222 Ni 22.55586073 12.15127993 20.79370897 -0.11339201 -0.42309369 0.12118850 Fe 22.54715677 10.37625539 22.53936691 -0.14096354 0.46084726 -0.17604571 Ni 20.78715010 12.11717790 22.52720795 0.48154360 0.12906401 0.40607694 Ni -0.02537662 13.82624307 20.81786987 0.17422285 0.39762503 0.26049533 Ni 1.73127070 15.63181990 20.81473727 0.35491739 -0.66119559 -0.00468043 Fe 1.76913254 13.85814547 22.56717102 -1.25788128 0.28358324 -0.01067495 Ni -0.03120467 15.58615654 22.52802680 0.74961186 0.09913830 -0.55233499 Fe 3.46687397 13.89138841 20.83841665 0.19818566 -0.44309137 -0.89319343 Ni 5.16898583 15.63131115 20.83282727 0.19312849 -0.38832966 -0.48826331 Ni 5.20243936 13.89107970 22.56982147 -0.22989122 -0.32911183 0.29030120 Fe 3.47471099 15.60953022 22.51995211 0.21739313 0.11751739 0.71685353 Ni 6.90771168 13.86830189 20.84225667 0.85110400 0.25364015 -0.32109206 Fe 8.66419185 15.62104537 20.79371111 0.15514125 -0.12266322 0.74921093 Ni 8.69029543 13.90635465 22.55740479 -0.49615755 -0.20752751 0.01916698 Fe 6.90885862 15.60041321 22.52186014 0.18743426 0.38312664 0.36911486 Ni 10.42299991 13.84204365 20.84841539 -0.18324945 0.74139844 -0.70315029 Fe 12.14274937 15.60942262 20.80706464 -0.13474786 0.15325801 0.22722253 Fe 12.12024105 13.89326575 22.55168064 0.78347483 -0.36437864 0.23646753 Ni 10.40038668 15.57683958 22.52487630 0.14254498 0.41616054 0.23205937 Ni 13.87113899 13.87835620 20.78981798 -0.00400554 0.03022497 0.53877701 Ni 15.63675332 15.60805537 20.81477083 -0.44810092 -0.15067505 -0.24996245 Fe 15.61039094 13.84652274 22.57888153 -0.46209650 0.18661070 -0.37681511 Ni 13.85162061 15.63005507 22.56781317 -0.00081367 -0.34628987 -0.29360773 Ni 17.35676853 13.85320224 20.79987669 -0.32657883 0.12753370 0.05320136 Ni 19.05259184 15.59678856 20.84243328 0.38929522 0.60601422 -0.87097275 Ni 19.08184043 13.86459112 22.51947259 -0.03477807 0.11051412 0.45600979 Fe 17.35037393 15.59809313 22.54737363 0.05264282 0.05690821 0.31532444 Fe 20.78617423 13.86232261 20.83521667 0.19089905 -0.43134208 -0.40879096 Fe 22.53162765 15.59710472 20.78256017 0.54983692 0.71537522 0.92694142 Fe 22.53533113 13.83228467 22.51390442 0.05655738 -0.08895360 0.25897069 Fe 20.80914696 15.63780802 22.57919692 -0.29427809 -0.29819663 0.21946084 Fe 0.01526560 17.32817218 20.79473117 -0.44716782 0.43796126 0.20946948 Ni 1.70796041 19.08578141 20.78579476 0.66050523 -0.37151764 0.31800597 Fe 1.75237266 17.31627593 22.52206209 -0.92705604 0.39237473 0.57961047 Ni 0.02320600 19.08606613 22.56064325 0.42970895 -0.50658090 -0.68667779 Fe 3.46569427 17.36001545 20.80583315 -0.15569632 -0.08616505 -0.38876154 Fe 5.20414515 19.06564309 20.83659363 0.38342845 0.33796419 -1.00332217 Ni 5.18946562 17.37174948 22.53868744 0.08910241 -0.27750985 0.34823416 Fe 3.45287138 19.08407084 22.53388814 -0.39102980 0.33730684 0.21687391 Ni 6.91347391 17.32864039 20.77634468 0.76539975 0.43904572 0.51165887 Fe 8.64680950 19.10990034 20.81054853 0.63760731 -0.93844733 -0.02245222 Ni 8.67623301 17.32783208 22.57017706 -0.33109940 0.12173937 -0.21780025 Fe 6.92578117 19.10125342 22.57288750 0.36886901 -0.76655407 0.27490755 Ni 10.40768620 17.32308131 20.84323040 -0.27264656 0.08650850 -0.88411618 Fe 12.10809387 19.10305751 20.78471160 0.81028704 -0.82754452 -0.03741873 Ni 12.12881108 17.32042331 22.54365138 0.24550083 0.19805406 -0.15907212 Fe 10.43710258 19.04844521 22.53576832 -0.46582204 0.05284832 0.39443921 Fe 13.88578357 17.38825593 20.78890129 0.03721226 -0.54191994 0.68620737 Ni 15.64109857 19.04771816 20.79114080 -0.29621970 0.71802334 0.79602640 Ni 15.58026162 17.30595462 22.53874276 0.52828753 0.33851547 0.04916864 Ni 13.88341996 19.05963422 22.54042263 -0.18567111 0.06870696 -0.06726422 Fe 17.31312125 17.32669386 20.78533531 0.61549332 0.23313327 1.02058496 Fe 19.11103310 19.05752380 20.81061444 -0.51710733 0.37935192 0.46475730 Ni 19.11260315 17.35899012 22.53676619 -0.49742651 -0.16009052 0.15193372 Ni 17.37634034 19.07216132 22.57840049 -0.36210445 -0.25568781 -0.55060851 Fe 20.80157325 17.38412421 20.82109192 0.16477152 -0.34704156 0.36679572 Fe 22.55110195 19.06995385 20.80099064 0.22632010 0.00461583 0.27123383 Ni 22.51448037 17.33491088 22.56847977 -0.51182966 0.15760788 -0.87934731 Ni 20.79296245 19.12795823 22.54918460 0.34019707 -0.37260083 -0.06559713 Ni 0.02793365 20.83907280 20.78815262 -0.67753646 -0.30126777 0.50098649 Fe 1.74786923 22.51978704 20.81435510 -0.54164267 0.87991956 -0.43664759 Ni 1.71673443 20.81264719 22.52658511 0.39101154 -0.22239079 0.28195262 Fe 0.06914382 22.56599064 22.51271085 0.04251247 -0.19262272 -0.15859738 Ni 3.44874980 20.83882657 20.79577878 0.98771385 -0.87996168 0.13799908 Fe 5.23279898 22.54065370 20.79570569 0.02228391 0.27202441 0.15945863 Fe 5.23348879 20.78049134 22.53829733 -0.47534596 0.39749843 0.40417876 Fe 3.43567409 22.55621597 22.52486355 -0.06611933 -0.19587637 0.11112791 Ni 6.95842961 20.80470633 20.84283618 -0.54123229 0.26672506 -0.31131344 Fe 8.66516938 22.54673860 20.78702819 0.38587974 0.13819647 -0.38067828 Fe 8.68981142 20.85419560 22.56120386 0.21924030 -0.43945993 0.24024458 Fe 6.97351736 22.54042854 22.54920470 -0.13048901 0.22053065 0.15791582 Ni 10.40512878 20.78947946 20.78276882 -0.22743227 0.39028946 0.49280324 Ni 12.11862813 22.57255655 20.83100115 0.36407282 -0.31492602 -0.48499018 Fe 12.14894617 20.78995442 22.55258256 0.27881357 0.12344898 -0.17275467 Fe 10.42249722 22.53211419 22.51117495 -0.06970406 0.19758143 0.22343081 Ni 13.88785045 20.78026021 20.79593686 -0.37111971 0.12997145 0.31930882 Ni 15.62923374 22.53153972 20.80180320 -0.15040392 0.25868309 0.29884885 Ni 15.60731971 20.83233074 22.56532151 0.38813028 -0.31665671 -0.27070681 Fe 13.86854890 22.54060320 22.53365155 0.20704939 -0.12966014 -0.42322865 Fe 17.35784888 20.80788851 20.79976412 -0.57789534 -0.29199769 0.68948674 Ni 19.08522008 22.53508611 20.82072625 -0.35016405 0.42203463 -0.06195038 Ni 19.04091523 20.78600421 22.52187303 0.21293099 0.42939665 0.15234594 Fe 17.33285892 22.57143857 22.54116156 0.06773057 -0.26295591 -0.18054166 Fe 20.81763551 20.84027379 20.83448283 -0.18290793 -0.44176576 -0.49781539 Fe 22.56036531 22.57136773 20.80444291 0.11332567 -0.01104296 -0.24571655 Fe 22.52924540 20.80693392 22.51984796 0.41269913 -0.09626089 0.34697479 Fe 20.79974775 22.52221774 22.54535281 -0.39645321 0.11519555 0.17584734