32 Lattice="51.2171081542969 0.0 0.0 0.0 51.2171081542969 0.0 0.0 0.0 51.2171081542969" Properties=species:S:1:pos:R:3:forces:R:3 energy=-92.94272009011034 stress="-4.812828389069229e-07 1.3273049192904948e-05 -2.9279783774730642e-05 1.3273049192904948e-05 -2.504243334170801e-05 -2.4199817391880753e-05 -2.9279783774730642e-05 -2.4199817391880753e-05 -3.7888857994536625e-05" pbc="F F F" Fe 25.48805832 25.72925957 25.72225283 0.20943110 -0.05928593 -0.31799143 Fe 27.61240459 27.28059860 25.47383338 -0.53013358 0.62368842 0.69579734 Fe 27.26131647 25.47113554 27.32416206 0.57916609 0.75050622 0.87492292 Fe 25.42366059 27.42318919 27.29469028 0.76192498 0.40067548 0.66824445 Fe 29.16424732 25.49587377 25.77738233 0.28336214 0.21032665 -0.07888871 Fe 31.15030245 27.19495271 25.49647250 -0.75619110 0.37774186 0.74557688 Fe 30.71578750 25.79419644 27.59260632 1.30058471 -2.16637716 -2.95497543 Fe 29.41994236 27.60091918 27.56011159 -2.15446294 -0.39309826 -0.60634752 Fe 25.58470306 29.41380422 25.73586495 0.19128064 -1.94382118 -1.55933713 Fe 27.61270602 30.90025222 25.73605600 -0.97871821 0.94972138 -1.22727829 Fe 27.46980581 29.23170777 27.27058938 -0.47954954 -1.62529661 1.27910569 Fe 25.57346521 30.88745422 27.24641654 0.30261106 1.73042537 1.64772483 Fe 29.42674077 29.41604826 25.85139467 -0.86575658 -1.86959474 -2.77214017 Fe 31.24019216 30.91192820 25.73275982 0.06528647 0.49359390 0.00093871 Fe 30.91352826 29.35532973 27.40943649 2.54754207 -1.03624055 0.84529110 Fe 29.10523582 30.94741470 27.44908316 0.85244514 1.80358558 1.10434230 Fe 25.47015521 25.58828359 29.31966833 0.41267112 0.26036603 -0.20356280 Fe 27.31896407 27.25312699 29.42959920 0.50919929 0.49366569 -0.76631545 Fe 27.30546001 25.47467280 31.17822951 0.25397471 0.37858536 -0.47670048 Fe 25.54177403 27.22437440 31.17171726 0.38919889 0.59329654 -0.48083085 Fe 29.49375197 25.56174172 29.37635994 -1.95418002 0.06987301 1.65255636 Fe 31.29970145 27.20934078 29.08779173 0.24909800 2.20278694 2.44792908 Fe 31.24914902 25.77762677 31.16562914 -0.61429501 0.48376399 -0.42837793 Fe 29.09679730 27.47923297 31.28022214 0.44828299 0.00128240 -0.92642199 Fe 25.80165029 29.41850501 29.11844809 -0.39120279 -0.97261713 0.18242016 Fe 27.61456362 31.03347950 29.37517449 -1.07074245 0.93581117 -1.35961896 Fe 27.25624026 29.50257059 31.04612942 1.21526172 -3.08950790 0.61652949 Fe 25.71991124 30.95195922 31.15472163 -1.20564127 1.29436512 -0.22996140 Fe 29.30735622 29.31253144 29.19659452 -0.49883951 -1.28072749 0.82514552 Fe 31.20994817 30.78263821 29.16526983 -0.01477169 0.75455084 0.32723502 Fe 30.92834310 29.35893458 31.10743228 0.12188079 -0.93092891 -0.24304135 Fe 29.12969765 30.88067334 31.04702223 0.82128278 0.55888390 0.71803004