32 Lattice="49.86811065673828 0.0 0.0 0.0 49.86811065673828 0.0 0.0 0.0 49.86811065673828" Properties=species:S:1:pos:R:3:forces:R:3 energy=-91.82628151833077 stress="-0.000400634879461849 1.6776617124810557e-05 -7.111511133425487e-05 1.6776617124810557e-05 -0.00040918772562970653 0.0001007450271714361 -7.111511133425487e-05 0.0001007450271714361 -0.0004095036393325822" pbc="F F F" Fe 24.90703079 24.95085326 24.83381181 0.79663515 0.91560002 1.15655429 Fe 26.94598868 26.61398526 24.72749764 -2.00647212 1.70670402 1.07023728 Fe 26.49110188 24.69925826 26.94162769 5.24309581 -0.33645908 -4.09906847 Fe 24.78589525 26.60135689 26.89823034 -1.99032265 6.23724978 -8.66549763 Fe 28.74587702 25.15943643 24.89622985 -3.54757318 -1.32521203 -3.74679238 Fe 30.33813332 26.88164031 25.04206533 1.44293064 -2.24115843 -4.57607302 Fe 30.17228268 25.06505872 26.51976633 3.17496008 -1.09447057 5.49683408 Fe 28.40029324 26.96312973 26.70067337 -3.31570356 -3.41231627 -1.94006137 Fe 24.81793588 28.63847666 24.90914803 -3.57520318 -4.49974975 1.04171293 Fe 26.46689527 30.04169956 24.81356725 5.38447584 5.07072105 -3.72587933 Fe 26.68606375 28.71469105 26.58871008 0.41923017 -5.50681048 1.03723879 Fe 25.10909995 30.45383161 26.67313170 -1.41333216 0.94639939 1.45752659 Fe 28.74268550 28.62698373 24.92607911 -5.63362246 -4.05297252 -2.79017445 Fe 30.15779384 30.25760396 25.14085747 5.70568231 4.06343800 -1.74429209 Fe 30.29541129 28.34301613 26.65284462 4.35083888 6.51719513 1.13920684 Fe 28.62163014 30.12242641 26.75152737 -2.78854862 5.56468746 -0.53796310 Fe 24.88931872 25.09467191 28.33542100 -4.60623935 -5.96602610 9.48607385 Fe 26.51649817 26.75949431 28.34025318 5.36891263 0.84564581 2.03039132 Fe 26.90764835 25.08988182 30.28739344 1.46709643 -1.44650650 -0.77480903 Fe 25.13726622 26.52914444 30.39974058 -1.53571545 1.99349742 -0.65618902 Fe 28.78708571 24.87050255 28.72572974 -5.90555830 0.74425206 -5.32324413 Fe 30.03808146 26.89619632 28.31776972 4.56595596 -6.44055948 5.06126757 Fe 30.36606276 24.76092719 30.14001566 3.98338407 0.95194408 3.72855952 Fe 28.49640511 26.92798634 30.36209877 2.77263728 -2.37859981 -0.44334012 Fe 24.92729601 28.55008570 28.36789707 -0.97550588 0.08683165 0.63579847 Fe 26.82205666 30.03186239 28.47075676 -2.56012710 3.41739723 -1.00951750 Fe 26.84494439 28.41602612 30.13728885 -3.09029607 1.31576443 0.89031437 Fe 24.70946866 30.37736744 30.24066092 1.56479314 -1.06646478 -1.26284072 Fe 28.70309589 28.61633541 28.29625900 -3.44849011 0.58960895 7.19811232 Fe 30.48414837 30.49299960 28.65455761 -1.00277104 -1.31659336 -0.67360502 Fe 30.44271480 28.52439249 30.38748599 -1.13180718 0.11977822 -1.12276869 Fe 28.36851885 30.31160942 30.11281515 2.28666001 -0.00281554 1.66228786