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=-5.865731560689779 stress="-1.259141370671229 0.1940893309049041 0.04909877067348008 0.1940893309049041 -1.362080363966929 0.1994661090079462 0.04909877067348008 0.1994661090079462 -1.6370764537649272" free_energy=-5.865731560689779 pbc="T T T" Fe 0.24624097 0.14302402 2.85498893 -3.45630482 -2.15560324 4.90737166 Fe 1.61042859 1.70947124 2.85512851 -0.70869585 -6.00663958 6.17109513 Fe 1.55280714 2.91333883 1.50144273 0.05648336 3.80171114 -7.89621412 Fe 2.87241235 1.32230844 1.41049160 4.10851731 4.36053167 -3.18225267