2048 Lattice="28.98765902038288 0.0 0.0 0.0 28.98765902038288 0.0 0.0 0.0 28.98765902038288" Properties=species:S:1:pos:R:3:forces:R:3 energy=-7689.464695387903 stress="-102.19550054783177 0.3022256140853443 -1.5416022276378492 0.3022256140853443 -103.78713314253986 1.772734197526944 -1.5416022276378492 1.772734197526944 -103.64848414073808" pbc="F F F" Fe 0.01131791 0.03063624 -0.00944984 0.43314318 0.46699694 0.42649185 Fe 1.84774515 1.84737946 0.01265216 -0.39705762 -0.33227554 -0.15571604 Fe 1.76841927 0.00000180 1.80232282 0.03263894 0.00395612 -0.16904473 Fe 0.01530630 1.82163580 1.80061493 -0.08691882 -0.15487420 -0.11662940 Fe 3.65324395 0.01214023 -0.02572265 -0.06288967 0.21149930 0.24360950 Fe 5.45425879 1.80929366 -0.00854028 -0.00984322 -0.07645405 0.04989046 Fe 5.42424067 0.03205417 1.83292225 0.11620257 -0.05988462 -0.16820896 Fe 3.60463265 1.76946073 1.76355247 0.10884590 0.08701039 0.15830801 Fe 7.27308392 0.03442889 0.00112829 -0.06528800 0.21221309 0.27392861 Fe 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