32 Lattice="7.236071799736634 0.0 0.0 0.0 7.236071799736634 0.0 0.0 0.0 7.236071799736634" Properties=species:S:1:pos:R:3:forces:R:3 energy=-92.19740443343302 stress="-0.006293519611450759 0.0002555642212500763 0.0005565326404637711 0.0002555642212500763 -0.007230172010995448 0.0011369210435843414 0.0005565326404637711 0.0011369210435843414 -0.007482720878752494" free_energy=-92.19740443343302 pbc="F F F" Fe 0.00878925 0.02019556 0.02091758 0.21929920 0.21787220 0.25912273 Fe 1.81741310 1.77680257 0.00841570 -0.19780067 0.11134708 -0.38650399 Fe 1.83778550 0.02705572 1.82472033 -0.20253892 -0.52441003 -0.04203487 Fe 0.00005271 1.81621746 1.84397095 -0.39276128 -0.17101501 -0.15704987 Fe 3.59037656 0.02999683 0.02193086 0.14434104 -0.17856827 -0.10080117 Fe 5.41611988 1.77855005 0.02797680 0.02807704 0.15201813 -0.14760549 Fe 5.45272187 0.02773703 1.77144108 -0.09245584 -0.11790184 0.15148569 Fe 3.61793420 1.81076047 1.80955387 0.12067982 0.10109677 0.15716367 Fe 0.01777337 3.59575560 0.02737391 -0.01394805 0.04631989 -0.08444812 Fe 1.82775035 5.44070205 0.01521720 -0.05177025 -0.08617686 0.09387664 Fe 1.77745279 3.58936951 1.80116223 0.32627550 0.11238756 0.12146714 Fe 0.01935348 5.39167945 1.83472719 -0.04833757 0.09722226 -0.12111093 Fe 3.60002009 3.61111162 0.03184143 0.12322526 0.13812206 -0.32451026 Fe 5.41874906 5.41023615 0.03199951 -0.25985076 -0.17292329 0.18059466 Fe 5.46210232 3.61876855 1.78015843 0.17332725 0.07209920 0.13733885 Fe 3.61538429 5.46254689 1.84284760 0.18352717 0.15256804 -0.21464406 Fe 0.01938698 0.03122103 3.63650648 -0.11839611 -0.19413366 -0.14942342 Fe 1.84074707 1.77371591 3.60594216 -0.01845879 0.38883452 0.03793938 Fe 1.79230718 0.04545510 5.40631390 0.10150451 -0.12581598 0.21778056 Fe 0.01286754 1.80121732 5.37738909 -0.08558970 0.17075769 0.11311227 Fe 3.63091997 0.00520269 3.68517351 0.20477576 -0.43997817 -0.14683219 Fe 5.42559966 1.78145317 3.60058359 0.36433858 0.06479481 0.10241285 Fe 5.45168291 0.01662564 5.45701167 -0.24937727 0.27338067 -0.24825306 Fe 3.64640486 1.84490807 5.41069048 0.13819248 -0.18045951 0.45905993 Fe 0.00364779 3.62230576 3.61534123 -0.26465088 0.10007340 0.23233298 Fe 1.84098857 5.42993046 3.58787453 -0.22986916 0.28417067 0.25643270 Fe 1.84420868 3.59790551 5.40763251 -0.29774217 0.16329704 0.32745615 Fe 0.03242873 5.44586977 5.42271683 0.32865877 -0.31283613 -0.31652376 Fe 3.63680361 3.63844683 3.64274293 0.04820495 -0.11156454 -0.35827390 Fe 5.42202577 5.44419686 3.65216420 0.01868707 -0.00816819 -0.13373131 Fe 5.44764785 3.65040515 5.41215921 0.03109627 -0.08291442 0.01100406 Fe 3.62133557 5.41744876 5.41960860 -0.03066325 0.06050391 0.07316612