108 Lattice="10.730028459579405 0.0 0.0 0.0 10.730028459579405 0.0 0.0 0.0 10.730028459579405" Properties=species:S:1:pos:R:3:forces:R:3 energy=-363.19319503889136 stress="-0.006035468559208941 0.0009989046733944946 0.0006718108476912564 0.0009989046733944946 -0.006639316444067683 -7.899111268664816e-05 0.0006718108476912564 -7.899111268664816e-05 -0.005980140994926506" free_energy=-363.19319503889136 pbc="F F F" Fe 0.01785711 0.02606944 0.00971731 0.31844325 0.26388012 0.25017915 Fe 1.80918834 1.78117747 0.00069790 -0.16972074 0.06231793 -0.05857720 Fe 1.75821886 0.00045332 1.81414533 0.08759719 -0.25800010 -0.32954367 Fe 0.01465988 1.75282735 1.80592134 -0.25952727 0.25265236 -0.20717592 Fe 3.53512767 0.00347505 0.02555623 0.08146786 0.05543875 0.11252104 Fe 5.38286241 1.79971992 0.00581215 -0.21873421 -0.10684487 -0.22745158 Fe 5.36679947 0.03420056 1.77307112 0.05467875 -0.32609128 0.04234222 Fe 3.59431289 1.76296858 1.81287006 -0.13315335 0.23842608 -0.28324460 Fe 7.13686644 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