500 Lattice="17.672811268309395 0.0 0.0 0.0 17.672811268309395 0.0 0.0 0.0 17.672811268309395" Properties=species:S:1:pos:R:3:forces:R:3 energy=-1838.0324813281068 stress="-63.713140998094495 -0.5307805887127302 -3.0800762090599534 -0.5307805887127302 -73.74943843453586 6.220734300426372 -3.0800762090599534 6.220734300426372 -70.67922645161903" pbc="F F F" Cr 0.00003368 -0.00288997 -0.02166686 0.33224255 0.08187890 0.37281628 Ni 1.81247910 1.75367522 -0.00466017 -0.52797000 0.90120478 -0.50196938 Fe 1.75632571 0.03435060 1.79288314 0.52448975 -0.86238154 -0.94835164 Cr 0.00894032 1.77269250 1.78151312 -1.04987298 0.09891739 -0.52738189 Cr 3.51196487 0.03173188 0.03380942 0.28332234 -0.74222571 -0.22439300 Fe 5.30274866 1.75405139 0.03477863 0.36983839 0.84159630 -0.96498643 Cr 5.29949863 0.03429845 1.76500159 -0.26123662 -1.37394744 0.48353817 Cr 3.54962633 1.78275946 1.74770509 -0.63942647 -0.56336141 1.25766868 Fe 7.07291365 -0.01994162 -0.00209401 -0.08762823 0.24612897 0.41490946 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15.89132149 5.30765049 -0.01169917 -0.26802144 0.26354540 -0.21452678 Cr 15.88855316 3.56341958 1.79371943 0.53253874 -0.54969994 0.24840928 Ni 14.13971146 5.31107310 1.79594503 -0.38862449 0.24838452 -0.35696547 Ni 0.00082334 7.03479859 -0.01369428 0.51311675 0.35164424 0.07362667 Fe 1.73982197 8.85855450 0.02460559 0.20758839 -0.30894090 -0.08731278 Fe 1.75207382 7.03616329 1.77169383 0.29501048 0.55837730 0.66672482 Ni 0.02080828 8.81809367 1.78857546 -0.44364701 0.04579453 -0.39006622 Ni 3.50838303 7.09134312 -0.01165745 0.28341140 0.45379520 -0.16562546 Fe 5.30005122 8.86676006 -0.03468786 -0.32145097 -0.90994281 0.25677746 Cr 5.31946011 7.09016215 1.76687467 0.00109109 -0.14844162 -0.37075277 Ni 3.53693860 8.86293060 1.76064682 -0.45369478 -0.39103553 -0.25070925 Fe 7.08959283 7.03771790 0.01845883 -0.27027081 0.21277296 -0.13447421 Ni 8.78660405 8.83861488 -0.00060967 0.42271216 -0.35021854 -0.38772495 Fe 8.85203736 7.05537184 1.78225022 -0.71634011 0.54317920 -0.39123915 Ni 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0.23488928 0.38849869 Cr 14.14908154 12.37303659 1.78616641 -0.65431039 -0.38186941 0.08449756 Ni -0.01824504 14.09044815 0.03972222 0.10849419 0.28956875 -0.01841818 Fe 1.76326596 15.88879335 0.03066141 0.17341296 -0.45677191 0.23226116 Fe 1.78050378 14.15378639 1.75955846 -0.26720568 -0.61678823 0.67174444 Cr -0.00696016 15.92687695 1.78275348 0.37474914 -0.31120183 0.58598169 Ni 3.51079557 14.10824628 0.03491347 0.63162742 0.30432451 -0.73393050 Fe 5.32798175 15.92493318 0.02767223 -0.32534172 -0.72449574 0.32945377 Fe 5.32248327 14.07544067 1.76558233 -0.49480851 0.38931413 0.36375945 Cr 3.51828111 15.90582224 1.79694264 0.30478884 0.37993172 -0.12749316 Ni 7.07074576 14.07831492 0.02879824 -0.39981717 0.54026750 -0.15063833 Cr 8.81778058 15.88544380 -0.03232878 0.09423221 0.62416369 0.17588021 Ni 8.85144039 14.14271102 1.73335954 -0.47500698 0.31142245 0.57469221 Fe 7.06974932 15.92233737 1.76001331 0.38631015 -0.19618552 0.31921790 Cr 10.59106672 14.15598330 -0.01815237 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15.92462489 0.21545596 -0.67883597 -0.49657655 Ni -0.01495980 7.03566931 14.15764537 -0.90316139 0.31722746 0.05328646 Cr 1.80223876 8.80683960 14.16610431 -0.25986974 0.38183031 -0.27537286 Cr 1.73763516 7.04837360 15.88588883 0.29673207 0.17504519 0.98391460 Fe 0.02974094 8.81124922 15.91352403 0.13284797 0.28653832 -0.42442077 Ni 3.51854997 7.07676250 14.10457315 0.90268685 0.25078284 0.29871077 Fe 5.29089487 8.84383978 14.16418605 0.23469860 0.27752401 -0.87598103 Cr 5.32809783 7.11936896 15.87093706 -0.36994820 -0.57380362 1.09223440 Fe 3.53866078 8.85300876 15.89984281 -0.13953773 -0.25646736 0.55065772 Fe 7.06607232 7.05371291 14.10258077 0.02669403 0.15817854 0.44808435 Fe 8.84561071 8.86586074 14.14043792 -0.21872464 -0.38144039 -0.10179601 Cr 8.81479529 7.08599744 15.91405255 0.69257191 -0.29889958 -0.26085414 Ni 7.08900435 8.80075328 15.92300725 -0.32428031 0.36178066 -0.67358549 Fe 10.61350474 7.10071286 14.11248462 -0.47713281 -0.35137932 0.36859575 Cr 12.34297778 8.81790979 14.13631038 0.56464997 1.30701243 -0.20045132 Cr 12.39473586 7.04870945 15.93943040 -1.11345583 0.18526804 0.43657456 Cr 10.57120207 8.84486612 15.89235851 0.61196860 -0.14199159 0.68493183 Ni 14.11863395 7.06763249 14.17177599 0.22983629 -0.16969243 -1.05090122 Ni 15.88339677 8.85582101 14.12745432 0.43392389 -0.09045241 -0.67994103 Cr 15.90333476 7.07054182 15.93796999 0.21500772 -0.26444409 0.43680812 Cr 14.14827941 8.82363014 15.94075326 -0.77180568 0.57689607 0.64749733 Cr 0.01364033 10.61865457 14.16865169 -0.80728454 -0.29067293 -0.36807152 Ni 1.77989245 12.37239096 14.11032073 0.05790924 0.52098419 -0.36887591 Cr 1.74945475 10.63820071 15.92385289 0.47603368 -0.62223502 0.64841489 Cr -0.02699434 12.40254699 15.87051331 -0.14353777 0.39778101 0.39801750 Fe 3.51421722 10.58178312 14.16859853 0.19606585 0.37903920 -0.55142475 Ni 5.28474379 12.40388870 14.15065765 -0.30516566 -1.16510972 -0.81129559 Cr 5.32713061 10.61562187 15.90091010 -0.77188238 -0.60734469 0.13817287 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15.92199479 -0.41222224 -0.62823354 -0.08287172 Fe 10.63389003 15.93769024 15.90058616 -0.32736745 -0.67302130 -0.51761865 Ni 14.11091770 14.12379084 14.13339967 0.60951769 0.03579649 0.17946197 Fe 15.87682510 15.90050664 14.07457171 -0.31534604 -0.26066002 0.31783931 Fe 15.89496082 14.10188243 15.92564272 -0.35020692 0.00663246 -0.52782918 Cr 14.12388319 15.87506479 15.88994442 0.53152543 0.36443806 0.22114384