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=-7.14353411968 stress="-1.1464913292373717 -0.37565540789383595 0.1301261344759024 -0.37565540789383595 -0.8329470214451192 0.1329902345064662 0.1301261344759024 0.1329902345064662 -1.184100778792014" pbc="F F F" Fe 0.18107110 -0.17174679 0.13102478 -2.60955163 -1.95768466 -1.07710381 Fe 1.36917430 1.54350451 0.01193751 2.75314717 2.24974577 -2.77555615 Fe 1.75226748 -0.03568003 1.54396501 1.47907041 -0.49321152 1.79978605 Fe 0.09267178 1.70379337 1.61825373 -1.62266595 0.20115042 2.05287392