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=-12.72638284763935 stress="-0.0004614942736459622 -4.192819601849849e-06 -0.000318863994163118 -4.192819601849849e-06 -0.0005930811010836751 5.903838952569629e-05 -0.000318863994163118 5.903838952569629e-05 -0.00042292093112295985" pbc="F F F" Fe 35.22086729 34.98310996 34.77096654 -1.01546120 -0.24426383 -1.49844074 Fe 36.59933616 35.93572417 35.98055861 -4.81674053 -14.88869817 11.80790658 Fe 37.14715992 37.22516294 35.23402360 -2.00368171 4.48782084 -20.06805456 Fe 37.93229823 38.31172061 36.19084223 7.18706369 11.71652682 7.27032960 Fe 37.29465675 35.14771729 38.20399864 -0.77804569 1.11969102 1.53354079 Fe 39.35802973 35.76443239 38.83490027 0.90854586 5.61410743 -16.21037524 Fe 34.76884260 38.20444678 38.02575960 -0.44489524 -2.29102990 1.18554389 Fe 36.55604684 39.07636534 38.99475015 -13.77631878 39.34270887 -22.65534878 Fe 40.23975440 35.55577733 35.25284888 -0.26607435 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34.84028743 42.83814538 37.63905551 -0.44822964 -1.90143992 -2.79748147 Fe 36.23098989 43.34220644 39.11824152 0.05388205 1.66525050 1.86056699 Fe 39.98907021 40.39204219 35.08823643 -2.12108919 0.15902336 1.55376445 Fe 41.60365422 41.12475624 36.46651109 -8.63766915 8.81075915 -5.63548100 Fe 42.13394120 42.99269121 35.43802235 -3.33666285 -0.23995699 -1.62266814 Fe 43.68701492 43.70706248 36.51627956 2.48890329 0.49105743 2.33504369 Fe 42.58087455 40.09122498 37.35935114 7.02930331 -12.41182754 6.93675709 Fe 43.90613398 41.55066690 38.06735362 0.63590819 2.67897251 0.12343006 Fe 39.66448343 42.68403127 37.11226018 28.52226827 -17.53493506 16.10908881 Fe 40.97555741 43.68141800 38.89352680 -8.08876379 3.57744646 -2.50777549 Fe 34.69956596 35.38305112 39.19257121 0.82955004 2.18968985 -1.05980024 Fe 35.74317334 36.09374280 41.26851604 -0.68845407 0.00029255 -5.80342725 Fe 37.00297454 37.99791377 39.62151619 16.97390998 -41.84220847 22.17783553 Fe 38.55150311 38.51894432 41.34725891 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Fe 35.64418629 41.24709340 41.08813660 4.81411185 7.82921644 5.86128322 Fe 37.82350393 42.21827495 39.80335328 -3.52803978 -11.62286645 -7.33298021 Fe 38.63834321 43.28337470 40.87827378 7.50865692 7.63592625 7.11081771 Fe 37.36102597 39.94186987 42.87644269 9.33405008 9.75753633 -6.86079941 Fe 39.33637875 40.35003375 43.92675119 2.32890345 -0.64181393 -1.43304043 Fe 34.73941240 42.81522600 42.59774323 0.70660635 0.44338199 0.46203388 Fe 37.01923225 43.67650819 43.69035511 -0.35083349 -0.45329186 -1.15764433 Fe 39.50420345 39.74812168 40.36805486 -1.25308644 5.84916289 -3.70318036 Fe 40.89974943 41.22892384 41.12165250 11.81391323 -19.35657076 -25.58993354 Fe 42.34497277 42.80178516 39.71375535 6.96092023 -3.98084332 6.35768341 Fe 43.88224436 43.86104153 42.13774413 -4.06800669 -0.69185271 -0.18191686 Fe 42.35815149 40.59276003 42.85318607 -6.45887823 -2.81008255 -4.93055154 Fe 43.69857829 40.94832775 44.06803044 5.53722795 1.38901628 5.04025002 Fe 40.39757659 42.11536967 42.13716159 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