108 Lattice="11.24398723283566 0.0 0.0 0.0 11.24398723283566 0.0 0.0 0.0 11.24398723283566" Properties=species:S:1:pos:R:3:forces:R:3 energy=-260.2782646639224 stress="-0.006713027685834187 -0.0004225795128032918 -0.00010786203195895449 -0.0004225795128032918 -0.0066769900832123795 -0.0003765744217189893 -0.00010786203195895449 -0.0003765744217189893 -0.006463352615399484" free_energy=-260.2782646639224 pbc="F F F" Fe 0.01898589 0.00931493 0.02429527 -0.28399298 -0.33074947 -0.30707547 Fe 1.89711579 1.84801384 0.02691182 0.33310695 0.97653040 -0.71992631 Fe 1.89601029 0.00050439 1.86423654 0.39544975 -0.90606357 0.72369668 Fe 0.02335923 1.86900295 1.85744598 -0.64488410 0.66981243 0.56118053 Fe 3.73247766 0.03625411 0.02823222 0.29887397 -0.59231890 -0.62697365 Fe 5.64984850 1.86473244 0.00590555 -0.48345298 0.84123765 -0.57837376 Fe 5.62932058 0.00403688 1.84940326 -0.38212650 -0.53798071 1.08399604 Fe 3.72959295 1.83715681 1.90105307 0.40487633 1.12855237 0.52725288 Fe 7.45877708 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3.70175731 1.89383321 9.38178635 0.13577497 0.40966423 0.48529069 Fe 7.49717826 0.01300743 7.52753938 -0.42369387 -0.67309273 -0.82547955 Fe 9.34773093 1.87805546 7.50789933 0.70250750 0.29881137 -0.73548695 Fe 9.37041065 0.00747746 9.39518590 0.24219540 -0.19709862 0.19770673 Fe 7.50701727 1.87107305 9.34624489 -0.68629245 0.55146819 0.78478412 Fe 0.03139453 3.77639367 7.49025950 -0.57754288 -0.28147490 -0.48918513 Fe 1.90618921 5.63215523 7.51122044 0.87997510 -0.23320414 -0.80127230 Fe 1.84679567 3.78373677 9.37446735 0.95921187 -0.10353288 0.40457417 Fe 0.02437271 5.61062483 9.34926251 -0.51793850 0.31130931 0.40941127 Fe 3.77070210 3.71063778 7.50192931 -0.41364288 0.46294242 -1.00424129 Fe 5.58614006 5.65397788 7.49460447 0.19792449 -0.49237354 -0.91190103 Fe 5.60733504 3.71472891 9.35729319 0.34412662 0.25340498 0.36949795 Fe 3.80711768 5.60505554 9.37033799 -0.39910151 -0.06127049 0.38787105 Fe 7.52415095 3.75065685 7.47980413 -1.02764965 0.26861297 -0.30706435 Fe 9.39333938 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