32 Lattice="6.0 0.0 0.0 0.0 6.0 0.0 0.0 0.0 6.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=18.9985448683 stress="-2.8097831655451033 -0.009063502649426297 0.10729491885813307 -0.009063502649426297 -3.8936459739674776 -0.6702448894368312 0.10729491885813307 -0.6702448894368312 -3.775065137720121" pbc="F F F" Fe 0.05521368 -0.07998135 0.40059926 -4.99098017 -10.82842470 -5.00125039 Fe 1.20342959 1.53046366 -0.00206453 23.94751542 -10.27115797 -29.35003044 Fe 1.78187239 0.01001192 1.35879198 -32.57141951 -22.72580885 19.89452395 Fe 0.10170120 1.53513772 1.21904386 -42.19450901 -31.49587271 23.81939121 Fe 2.76647448 0.24624097 0.14302402 19.00228299 -16.45790494 -46.40512326 Fe 4.35498893 1.49550460 0.20947124 7.61480496 -6.58951004 -14.21969828 Fe 4.35512851 0.05280714 1.71102337 9.25069602 -9.77547396 -4.32936914 Fe 2.82929181 1.37241235 1.32230844 4.24690606 29.96563736 17.81433715 Fe -0.08950840 2.72286420 -0.06141927 -32.59876049 13.31731605 -35.87499605 Fe 1.11271087 4.62499906 0.05988540 1.01339358 5.13165834 -5.21188218 Fe 0.90466063 2.88186968 1.16967160 39.74145680 35.23320220 26.06597181 Fe -0.01155935 4.43194861 1.66207313 -6.26947779 7.81556888 3.22940552 Fe 2.72204232 3.17103028 -0.00568962 0.73285677 -0.50513359 -6.75806073 Fe 4.66782583 4.56310742 0.35120695 1.07323249 2.85473927 -1.49913943 Fe 4.33096497 2.87244051 1.28987791 10.65508865 10.88468396 -1.95383844 Fe 2.69666895 4.27696427 1.65784459 -3.44246185 7.85229234 -4.63316346 Fe -0.03487808 0.22586561 3.29391194 -11.61919762 -69.86720948 -58.25503861 Fe 1.22614529 1.54304438 2.59395704 15.96393661 -4.51135090 7.21832400 Fe 1.60754445 -0.12070884 4.55016964 3.27821740 -2.05661768 3.59388553 Fe 0.07100342 1.27538150 4.20296332 0.85292147 63.86576941 61.57541003 Fe 2.84887301 -0.05865179 2.78984966 1.38655734 -4.13364455 13.98273449 Fe 4.48735431 1.61573140 2.71421298 13.95290103 -7.05879352 7.43062304 Fe 4.44279777 -0.11842475 4.51538952 0.93454431 -1.52864392 0.21087983 Fe 3.33105938 1.76120756 4.51009773 -4.97367647 -4.86082641 3.42495785 Fe 0.25226748 2.96431997 3.05679776 -13.84041446 7.29758069 -5.42135459 Fe 1.77307483 4.53237374 3.38575403 -0.29901291 3.83078236 -5.70362207 Fe 1.26922180 2.87172039 4.52031036 10.18920018 -4.17779703 12.59870667 Fe 0.18745344 4.47722177 4.37970777 -8.06261605 5.68611744 5.42794384 Fe 3.27711528 2.87871118 2.75213077 -24.41247960 -8.98067878 5.49022048 Fe 4.23125112 4.21824351 3.13616082 24.53777008 15.82473895 -19.82003873 Fe 4.26429260 3.40528199 4.71980528 19.44767193 -21.97673612 16.75266301 Fe 3.29977655 4.68543805 4.45460942 -22.54694815 28.24149790 15.90662739