32 Lattice="6.885522221866317 0.0 0.0 0.0 6.885522221866317 0.0 0.0 0.0 6.885522221866317" Properties=species:S:1:pos:R:3:forces:R:3 energy=-104.06402352263743 stress="-0.011204705235718804 -0.0025285365649830313 0.0034694958319331556 -0.0025285365649830313 -0.014419819485427457 0.001374313970596 0.0034694958319331556 0.001374313970596 -0.014722552070119238" free_energy=-104.06402352263743 pbc="F F F" Fe 0.02088997 0.03167315 0.01720602 0.49252408 0.24180155 0.46155607 Fe 1.68700042 1.69590121 0.01045772 0.08923133 0.29693333 -1.20014784 Fe 1.72362128 0.00459153 1.71718052 -0.18939630 -1.15217232 0.13645167 Fe 0.02685131 1.69931203 1.69928865 -1.26012161 0.21186941 0.10799229 Fe 3.41364408 0.00183223 0.04732225 0.17897052 0.02706990 -0.15070075 Fe 5.16318974 1.69422054 0.00280551 -0.22937565 0.10009893 0.24710719 Fe 5.16181578 0.00743255 1.70330442 -0.19808290 0.25590343 0.09638605 Fe 3.41794694 1.73465286 1.72928932 0.27682456 -0.50211595 -0.10104896 Fe 0.00016481 3.50263107 0.01901231 0.04777173 -0.37342592 0.04485499 Fe 1.70403275 5.15816074 0.03793781 0.14541682 0.15156872 -0.14911756 Fe 1.72799648 3.44759001 1.73075783 -0.38808405 0.10928236 -0.20837503 Fe 0.00234492 5.15639211 1.71541397 0.05359195 0.15790148 0.17798832 Fe 3.44047487 3.43732364 0.02952499 0.28415537 0.20555760 -1.12004977 Fe 5.15824860 5.14394029 0.02283822 -0.75505074 -0.80472591 0.83836775 Fe 5.13770491 3.40931657 1.75275412 1.07511974 0.68932964 -0.58798796 Fe 3.42987726 5.17262315 1.72048670 0.60065687 0.91384172 -0.17575905 Fe 0.02895935 0.00921331 3.45077407 0.03906639 -0.11652645 0.08046730 Fe 1.67611162 1.72791394 3.45614208 0.27553672 -0.37159471 -0.12034824 Fe 1.76580070 0.00965081 5.18859470 -0.20212464 0.18661459 -0.15520918 Fe 0.01997234 1.73112076 5.14188936 -0.16320666 -0.14577829 0.19129974 Fe 3.45469739 0.03435762 3.46235522 0.37484936 -0.95808627 0.09400789 Fe 5.19003823 1.75372654 3.42346915 0.89405603 -0.81320949 0.56276131 Fe 5.18874658 0.00636408 5.19053131 -1.05167194 0.98890311 -0.95540716 Fe 3.42741248 1.74326487 5.13185701 0.73840483 -0.44772675 1.13349330 Fe 0.01744605 3.47634411 3.44447790 -1.04793917 0.23972979 0.21348372 Fe 1.75143552 5.17530288 3.45462080 -0.44219791 0.93523618 0.44916124 Fe 1.72020517 3.41005023 5.16503176 -0.18610084 0.88093439 1.06405171 Fe 0.02200303 5.15071702 5.19654276 0.85210512 -0.84426941 -0.79663511 Fe 3.42392232 3.43584606 3.44150372 0.23150511 0.48798658 0.27569315 Fe 5.18485529 5.15208374 3.45784493 -0.34903509 -0.02885657 -0.25738445 Fe 5.17104281 3.47764656 5.10536602 -0.05141746 -0.12256703 0.15576220 Fe 3.47137614 5.18621153 5.18893730 -0.13598156 -0.39950766 -0.35271484