32 Lattice="50.48823165893555 0.0 0.0 0.0 50.48823165893555 0.0 0.0 0.0 50.48823165893555" Properties=species:S:1:pos:R:3:forces:R:3 energy=-43.504285405190174 stress="-0.0005697369656808726 5.15730784324228e-05 -6.361810879617359e-06 5.15730784324228e-05 -0.0005794416066238428 9.611448829970223e-07 -6.361810879617359e-06 9.611448829970223e-07 -0.0006022305313897432" free_energy=-43.504285405190174 pbc="F F F" Fe 25.15169657 25.33674483 25.33615679 -1.31780553 -1.64050443 -2.38120359 Fe 27.22193504 26.89012905 25.13105293 -2.11691557 5.18902964 -1.94393300 Fe 26.87084692 25.35565418 26.97503686 1.20351937 -1.93311657 3.43209149 Fe 25.10785179 27.06292434 26.90422073 -1.06351827 2.00669638 1.35548290 Fe 28.53646011 25.20990599 25.39788934 3.73973397 -4.21444495 -1.26344418 Fe 30.64111917 26.80448316 25.29928595 1.58697724 1.28336239 -2.83859965 Fe 30.47692438 25.42975819 27.20213677 1.58295748 -6.50084366 -4.53307303 Fe 29.00344151 27.21044963 26.92250002 -4.69584085 -2.02987973 3.44404295 Fe 25.46877754 28.99730337 25.12246982 -1.46443457 -2.89007419 -2.41148533 Fe 27.13961285 30.64696197 25.37161776 0.46776033 2.84542694 -3.02225668 Fe 27.07761582 28.81520691 26.97936827 1.01664613 -3.49801808 0.23022429 Fe 25.20902696 30.56044990 26.85594699 -1.60404144 3.62103907 0.67743663 Fe 29.01023991 28.99954741 25.48695642 -3.02579604 -2.51687917 -8.41246383 Fe 30.74903055 30.68068240 25.36832158 1.06954672 1.81538420 -0.88292302 Fe 30.47099610 28.93882887 27.01896694 7.37297860 -1.05038291 3.56225732 Fe 28.68873496 30.50488254 27.05861361 1.36925508 6.00247818 2.90208012 Fe 25.12077171 25.22384534 28.90316748 -2.19844928 -1.24257067 -2.02166252 Fe 26.99514564 26.86265744 28.84584666 2.20496040 3.49778026 -1.59472120 Fe 26.91499046 25.11195499 30.50080370 2.82152725 -3.15133698 1.63661149 Fe 25.41222944 26.83390485 30.72918511 -2.03249378 3.37265141 1.55437155 Fe 29.07725111 25.18896021 28.95985909 -3.81384708 -1.35810920 0.35470061 Fe 30.87005813 26.81887123 28.67129087 2.02707504 6.43130671 3.86076059 Fe 30.81496013 25.40029968 30.72309698 0.79362293 -0.40273187 1.23646284 Fe 28.76504745 27.00401241 30.73596802 -0.64282807 1.23989376 0.31526569 Fe 25.43721204 29.00200415 28.46781712 -2.68311454 -2.68927573 4.15913241 Fe 27.22409407 30.59094734 28.95867364 -1.48156327 3.51780462 -2.80621969 Fe 26.86577071 29.08606974 30.70531922 2.81789702 -7.80826558 1.27498773 Fe 25.35547299 30.50942707 30.71218947 -4.64778553 3.96362154 0.25536931 Fe 28.89085537 28.89603058 28.78009366 -2.25177767 -4.06212083 0.44880668 Fe 30.76810436 30.57423617 28.95328144 0.79403772 3.14087181 -2.29677645 Fe 30.48581094 28.94243373 30.45969931 2.74125170 -4.01834843 3.08574262 Fe 28.71319680 30.43814118 30.72533262 1.43046452 3.07955607 2.62293497