108 Lattice="11.198082633033792 0.0 0.0 0.0 11.198082633033792 0.0 0.0 0.0 11.198082633033792" Properties=species:S:1:pos:R:3:forces:R:3 energy=-351.8546816175182 stress="-0.003454911932255961 0.000891908620010743 -0.0009934901708015182 0.000891908620010743 -0.004658065490122343 0.001434189841651517 -0.0009934901708015182 0.001434189841651517 -0.003509316189743469" free_energy=-351.8546816175182 pbc="F F F" Ni 0.04961774 0.00428897 0.02164254 0.00911506 0.19441771 0.03407645 Fe 1.92155578 1.85862401 0.01884670 -0.07886962 0.16536622 -0.50267796 Fe 1.84697275 0.02105787 1.89976729 0.33920764 -0.68127192 -0.10808812 Cr 0.01181833 1.84880626 1.83122722 -0.34234216 0.16899598 0.36507850 Fe 3.70432501 0.02540185 0.05001584 0.26475260 -0.28823231 -0.14797512 Ni 5.62561892 1.89140173 0.05706842 -0.34318810 0.25329719 -0.17901358 Fe 5.60345386 0.02454584 1.90009536 -0.10547099 -0.62351368 -0.23403560 Ni 3.72185468 1.83684527 1.90157482 0.28056891 1.41544840 0.56598644 Ni 7.47874229 0.01488078 0.02991110 -0.08944362 0.16935469 -0.14774389 Ni 9.36132023 1.85115206 0.02121442 -0.24259418 0.17838905 0.09211985 Cr 9.34293950 0.01040660 1.88588756 0.14883741 -0.42560190 -0.10977956 Fe 7.45235732 1.83413228 1.83591538 -0.16566230 0.67150479 0.73867853 Ni 0.01562958 3.70607808 0.02457868 0.15454194 0.06918911 0.15435840 Cr 1.86515114 5.61341105 0.03292149 0.32205278 -0.37232808 -0.37838221 Ni 1.87733433 3.76146926 1.85090155 0.40832594 -0.45695948 0.33856748 Ni 0.03099554 5.58242158 1.85065672 -0.28743798 -0.56343602 0.04577318 Cr 3.77074490 3.76363231 0.01017193 -0.11831255 -0.49019305 -0.09994980 Fe 5.56774715 5.58833558 0.02394152 0.54887156 0.39799351 -0.46600335 Ni 5.57495579 3.72793361 1.86253505 0.27227840 -0.36038400 0.68956774 Ni 3.76608298 5.54980274 1.85764266 -0.27326726 0.28195783 0.81023789 Ni 7.49526607 3.73799787 0.01248953 -0.45412343 -0.19625726 0.10351252 Fe 9.30861904 5.55609215 0.01300315 0.21181653 0.29080120 -0.39728763 Cr 9.32978202 3.75386152 1.87823305 0.23641880 -0.23256562 -0.10589607 Ni 7.43790383 5.62522215 1.88735226 -0.19497444 -0.31070342 0.12200309 Fe 0.02001498 7.43763003 0.02428064 -0.28960297 0.19497042 -0.15100985 Ni 1.84848484 9.30498801 0.01393110 0.34351117 0.28342596 -0.07330435 Fe 1.86739608 7.40998274 1.83153241 0.51633438 0.28676092 0.65552443 Fe 0.03339515 9.32921524 1.88166863 -0.25038293 -0.03333860 0.13466857 Fe 3.73937149 7.47025443 0.00349901 0.01589044 -0.23537119 -0.08184137 Cr 5.62013885 9.33862258 0.01146289 -0.34348237 0.18562797 -0.27007334 Fe 5.60654380 7.49609757 1.88683732 -0.14740575 -0.72494359 -0.14077543 Ni 3.74683333 9.29043886 1.91322975 -0.23914100 0.19245386 0.06790091 Ni 7.46579664 7.47929882 0.03334806 -0.23068922 -0.69965198 -0.25797418 Cr 9.31484332 9.27970285 0.02135619 0.32684385 0.10289907 -0.19313522 Ni 9.31100861 7.44423197 1.83668877 0.16773881 -0.37422923 0.32061858 Fe 7.47947081 9.31749304 1.84230127 -0.15963534 0.58414325 0.59641192 Ni 0.04643956 0.02701646 3.80306955 0.00302023 0.29851035 -0.09556052 Ni 1.92312125 1.85741035 3.74240311 -0.08408977 0.91898777 -0.07541145 Ni 1.85020967 0.01286606 5.58275703 0.19659023 0.06186180 -0.15692031 Cr 0.00873401 1.90507689 5.63466271 -0.44297079 -0.17117993 -0.74025437 Fe 3.72998965 0.00912024 3.70692278 0.28008640 -0.54698224 0.30166837 Ni 5.62873252 1.85750036 3.77982008 -0.28223156 0.61652520 -0.19923544 Ni 5.60597537 0.03754877 5.62387184 -0.01708727 -0.15492474 -0.62669995 Ni 3.76582513 1.87338900 5.55738431 -0.16337242 0.64198467 0.15289439 Ni 7.45703360 0.02858718 3.72347656 -0.19560155 -0.35159317 0.25913399 Fe 9.32790060 1.84103437 3.70790116 0.14914940 0.43191903 0.05713165 Ni 9.31622728 0.00056711 5.56304451 -0.14500178 0.01399450 0.29772913 Fe 7.43788749 1.84756610 5.59271953 0.29957411 0.44561146 0.28139000 Cr 0.02224253 3.73879536 3.71210796 -0.35610731 -0.32194585 -0.33772799 Fe 1.83936872 5.57725129 3.71088419 0.93656562 0.74075545 0.21910333 Cr 1.86059501 3.76743978 5.58366608 0.61167827 -0.62421482 0.14035500 Fe 0.00974405 5.57856389 5.56471919 -0.25335888 0.62390830 0.39901471 Cr 3.76294709 3.75055024 3.76400927 -0.06978816 -0.64484251 -0.55120440 Cr 5.61737127 5.59178091 3.72262208 -0.47246738 0.27023606 -0.15391221 Ni 5.61863753 3.71798895 5.59984433 -0.17454813 -0.03031722 -0.12621019 Cr 3.73274989 5.60440871 5.56444093 0.22396311 0.20231504 0.20665272 Cr 7.44445348 3.73108793 3.69784431 -0.40038698 -0.29084732 0.05985419 Cr 9.29517497 5.59587382 3.76308735 0.42235119 0.31165012 -0.39923369 Cr 9.33227521 3.69732198 5.56542434 0.26172891 -0.12965213 0.34843050 Cr 7.47777821 5.56597672 5.63440121 -0.54711745 0.39333506 -0.40151529 Fe 0.02467962 7.41902221 3.70900519 -0.20197898 0.36127048 0.26216044 Cr 1.86060312 9.30822130 3.74888698 0.46753358 0.22000205 -0.32069464 Fe 1.90272577 7.48363843 5.60875299 -0.45169675 -0.58644905 -0.45427754 Fe 0.03447752 9.34107256 5.63044741 -0.23363863 -0.13575473 -0.23055859 Ni 3.74832620 7.47300816 3.69817749 -0.24625123 -0.61506749 0.16901875 Ni 5.61038590 9.35482783 3.69943971 -0.14021423 0.00774873 0.46312960 Ni 5.57977922 7.50169481 5.61362435 -0.07755736 -0.51442761 -0.42278887 Cr 3.73994010 9.31255077 5.61462107 0.26442245 0.43330120 -0.23782312 Fe 7.44441531 7.49105054 3.71212772 -0.15777446 -0.24112799 0.52670014 Fe 9.31083415 9.30409422 3.72062463 0.10264044 0.20573116 -0.08930665 Cr 9.33660510 7.49593688 5.62505808 0.31707687 -0.23056713 -0.19184724 Cr 7.43635839 9.35677731 5.63044359 -0.26717306 0.34237767 -0.37032212 Cr 0.01165496 0.01293394 7.45530518 -0.40863693 -0.63495069 -0.14249267 Cr 1.86626032 1.83174040 7.47812404 0.64220513 0.53029776 -0.67154072 Cr 1.88410736 0.01525039 9.34581187 0.18328773 -0.54351126 0.35213728 Cr 0.03662458 1.86216161 9.34565854 -0.50576297 0.11324913 0.58306826 Fe 3.72716067 0.01293673 7.40865820 0.17127749 -0.34253818 0.38218954 Fe 5.57251814 1.84534312 7.46754398 0.34777930 0.90630747 -0.15678339 Cr 5.61178303 0.03584138 9.32855002 -0.12158016 -0.47177730 0.21715237 Fe 3.73244202 1.91679406 9.31494562 0.28895794 -0.10063500 0.20675974 Cr 7.48841985 0.00720502 7.46207048 -0.02258329 -0.43197192 -0.33731061 Ni 9.34251381 1.89794434 7.47542178 -0.19740574 -0.18073109 -0.50369824 Fe 9.31760556 0.01634327 9.36103115 0.10608205 0.22933296 -0.12830525 Cr 7.46503368 1.87253738 9.31700133 -0.06238305 0.21827608 0.26804642 Cr 0.02267670 3.72064876 7.49530344 -0.49151836 0.33046179 -0.24799632 Ni 1.87539278 5.56283061 7.44639281 0.25272147 0.66441563 -0.24850673 Fe 1.89364555 3.71996082 9.36483931 0.19614451 0.24806281 0.28131634 Fe 0.00941472 5.56804960 9.29522780 -0.09095418 0.25700282 0.40092153 Fe 3.70802975 3.73875720 7.46181409 0.69402111 -0.48385218 -0.22963268 Cr 5.60924554 5.57167747 7.44561164 -0.02325585 0.31566269 -0.12719078 Fe 5.61539841 3.74657079 9.36584999 -0.09049652 -0.32855663 -0.25286616 Cr 3.75901294 5.59664793 9.30827638 -0.22543703 0.19219064 0.49060239 Ni 7.48301175 3.74332264 7.44395059 -0.78858275 -0.45454930 -0.22122284 Fe 9.35953972 5.59643803 7.48583247 0.14537779 0.16727555 -0.14829111 Fe 9.30954716 3.71865855 9.30543272 0.39221047 0.23230097 0.52826988 Cr 7.46422660 5.63230670 9.33637409 -0.25245580 -0.00168422 0.26975749 Cr 0.01293613 7.49592893 7.50113211 -0.45433419 -0.40116344 -0.27781881 Fe 1.86192349 9.31169500 7.47395954 -0.12202186 0.68408866 -0.22593313 Ni 1.87756699 7.47211243 9.33578910 -0.09333919 -0.34168379 0.14656119 Ni 0.00534125 9.31554962 9.35937532 0.31752725 -0.29518826 -0.16777715 Cr 3.71059863 7.49257599 7.48985321 0.50952889 -0.74196399 -0.27078487 Ni 5.63386807 9.35437104 7.49109844 -0.37048199 0.01247555 -0.19401752 Ni 5.60865779 7.50022199 9.36321121 0.11833808 -0.13814734 -0.25713849 Cr 3.72472389 9.36591218 9.30044526 0.25687778 0.28654488 0.53636855 Fe 7.44241584 7.49674319 7.42996374 0.28629966 -0.61375162 0.29814430 Cr 9.33397674 9.35267693 7.47399029 0.13340977 0.18894243 0.17662582 Fe 9.33009407 7.40016382 9.32740395 -0.06916553 0.28044430 0.03233171 Ni 7.44748881 9.33529875 9.32499204 -0.01869774 -0.32082396 -0.11394555