4 Lattice="3.0 0.0 0.0 0.0 3.0 0.0 0.0 0.0 3.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=-7.157683362133166 stress="-0.4559264141803056 -0.09019296664329172 -0.08790642115331665 -0.09019296664329172 -0.5934324298942406 0.01549287790254997 -0.08790642115331665 0.01549287790254997 -0.5576245266446268" free_energy=-7.157683362133166 pbc="T F T" Fe 0.29140871 0.11455359 0.03253581 -2.97963840 -5.29811086 -3.17981325 Fe 1.64904689 1.28091226 0.10609294 -1.23088119 6.68312087 -3.65467848 Fe 1.46603997 0.01361598 1.35198705 1.43843118 -6.60411623 3.90859360 Fe 2.75414399 1.56329927 1.43745442 2.77208840 5.21910622 2.92589813