64 Lattice="70.0 0.0 0.0 0.0 70.0 0.0 0.0 0.0 70.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=67.39085337310006 stress="-0.0013559624958237417 -0.0008497583434890364 -0.0001769084974386377 -0.0008497583434890364 -0.0010827617942637062 -6.948830949231234e-06 -0.0001769084974386377 -6.948830949231234e-06 -0.0017528728640884995" free_energy=67.39085337310006 pbc="F F F" Fe 34.58290937 35.20439626 35.40750899 0.88862000 0.78005338 0.53485800 Cr 36.55607962 36.60603343 36.50949199 -40.54570723 -50.46286433 58.79693177 Fe 37.29273725 37.42709151 35.44742274 17.56687993 18.62747764 -61.33587241 Cr 38.44590517 38.73392833 35.42236630 -104.13342343 -41.78279551 44.09388856 Cr 37.58727912 35.42157905 37.96810375 -1.96326089 -1.65583117 0.69697918 Cr 39.21070628 36.50238673 38.58193849 -10.68618500 -26.17841119 23.11723637 Fe 35.37229896 37.91557061 37.46598493 -66.37198637 -65.43807984 -130.97914290 Cr 35.88947284 38.47781713 38.55504928 57.57629524 62.71947437 123.64069637 Fe 39.81855080 35.47645041 34.71158694 -1.48317902 0.51700548 -0.72712776 Fe 41.36542791 35.76944193 36.02602983 -0.78232032 -0.02797750 2.12502475 Fe 42.91107280 36.61399795 34.94128285 1.16331222 0.99047109 -0.23122447 Fe 43.90014478 39.33896326 35.87090031 5.01159530 -3.58965810 -15.70486670 Fe 42.67891561 35.10370416 37.76508142 -7.14687985 -2.49533811 -2.78343515 Fe 44.22030636 35.70877849 38.49187673 6.73247436 3.19976553 3.56352553 Cr 39.59921688 37.38898356 37.87832058 11.45310947 28.89362910 -23.62007682 Fe 41.41140802 38.27987196 39.39730178 -0.96723670 1.03277389 -0.56121648 Cr 35.02862049 40.19761992 35.08825330 0.51297406 -0.53771758 0.20087127 Cr 36.05627812 41.91650845 36.23946240 -0.46694532 -1.35444027 2.05365190 Cr 37.41508638 42.51567645 35.16437386 1.33133771 -0.22884555 -2.09595116 Cr 38.58203368 43.79908255 36.41755828 0.38738276 0.21465506 1.07659006 Cr 37.35593507 39.70925024 37.56189841 -9.62323582 -8.96390341 -9.84804841 Fe 38.57669840 40.82683866 38.42605562 9.08200268 8.57654548 9.06055205 Cr 34.99918509 43.38923576 37.40139918 -0.05977341 0.76640219 0.74930485 Fe 36.66650179 43.41727089 39.59166975 -3.37870423 5.65396978 -4.82986367 Fe 39.57783301 39.34844081 35.03842997 130.15199518 70.73507718 -43.55921723 Fe 41.02062954 41.59180713 36.43268637 12.25129186 -8.50163838 -12.36147712 Fe 42.53588008 42.59455963 35.56098791 1.67207413 0.94617099 -0.42526368 Cr 43.79942431 44.14223101 36.17402287 -0.04112815 -0.09076680 0.17489705 Fe 43.35905606 39.66479031 37.45012258 -5.55723067 -1.08684852 13.40241917 Fe 43.13056706 41.23522040 38.50277847 -1.23671017 4.02175916 2.16245248 Fe 39.88465067 42.12159537 37.54005493 -46.26682148 -39.49638259 -24.42547833 Cr 40.67158581 43.22110136 38.40017598 33.43245446 47.13351618 37.59221118 Fe 34.96756783 35.49135582 40.34836566 -55.43943695 -53.29743058 -32.81987125 Fe 35.89981165 36.38412559 40.89634390 55.58192898 54.64238795 30.99947713 Cr 37.30745623 38.20172488 39.57058540 6.37712756 -4.13901000 1.82895939 Cr 38.13313449 39.04413687 41.12056778 -1.32877889 -1.75745034 1.96114344 Fe 37.16099150 35.56967703 42.51270000 -3.66290265 -1.86644635 -2.60622612 Fe 38.46418547 36.04757672 43.83132863 -8.00536573 -10.39332497 25.81991621 Cr 35.71330791 37.97426462 42.68182766 -0.78578386 -2.35960590 -1.11527253 Fe 36.47410853 39.38821723 44.10152488 -15.70933826 -9.52513479 64.53744429 Cr 40.51813769 34.83676740 39.53374120 0.51279659 -0.52872968 -1.68222968 Cr 40.91337195 35.43013677 41.47042554 0.67659840 1.13387334 1.28462173 Cr 42.96262330 37.39915706 40.41636561 -2.60820253 -7.73051717 -1.60237291 Cr 43.69286078 38.65060718 40.95321502 2.88523796 6.43962567 2.60976374 Fe 42.69820559 34.97575612 42.57070178 -0.42688466 0.22688948 -0.58866989 Cr 43.98729521 36.33223635 43.77568073 -0.19494432 0.58748357 0.08176208 Fe 39.12161725 36.73263033 42.52374765 12.45093274 13.52625952 -22.73517400 Fe 41.44382715 38.52730399 43.66495385 -0.15008762 -0.04341610 -1.27790441 Cr 35.54103971 39.51040240 39.81612871 -1.64664285 6.49035404 8.07833349 Cr 35.55855184 41.49556388 41.70007702 1.28690132 -1.28778145 -2.84675256 Cr 37.47653661 42.01210382 40.65399968 4.67965349 -7.71122117 4.47761061 Cr 39.38238914 43.67343808 41.23331722 -22.07867090 46.87442866 -58.89252709 Cr 36.86395895 39.63694941 42.55933712 16.72975349 13.60226339 -63.49089969 Cr 39.20779533 41.05682223 44.06773966 -0.29274658 -0.87128214 -0.59533079 Cr 34.64344555 42.15869124 42.98240951 -1.20917133 2.02798863 3.57014759 Fe 36.24088640 44.11925920 43.84990670 -0.62219704 -1.20424172 -0.74251512 Fe 39.64524424 40.19092780 40.48148769 2.69932875 2.19766423 -1.17008345 Cr 41.27662645 41.62590939 41.34407382 -1.28034670 1.56006284 -2.27356631 Fe 42.68960505 42.98761879 39.93698748 -40.24917856 0.65491544 -37.36145887 Cr 43.89831335 42.98765900 41.06825373 39.58031921 -0.68680989 38.11568087 Cr 42.60555317 40.94410038 42.38681939 -1.75796917 -6.47880629 -3.69966495 Fe 43.55713921 42.03086814 43.68197091 3.39845702 5.13305788 4.98627358 Fe 39.83420662 42.72485358 42.39796922 18.54700846 -49.37161911 56.02258683 Fe 41.16342922 43.77202353 43.31049584 3.53953332 1.23832534 1.57297040