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=3.1780247175324554 stress="-1.3846922590957829 -0.3778580381653977 0.5288863955853207 -0.3778580381653977 -2.6057905094900597 0.7460108444012545 0.5288863955853207 0.7460108444012545 -2.3500527987769178" pbc="F T T" Fe 0.22094491 0.23171545 0.18190327 -12.98111229 -0.70250381 -4.78469554 Fe 1.32183498 1.71219253 -0.07514625 11.21034010 -22.57833052 17.72012251 Fe 1.62990665 -0.21779550 1.78278197 16.15417123 24.72018391 -22.86159850 Fe 0.06210000 1.70397289 1.32702941 -14.38339904 -1.43934959 9.92617153