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=-3.16372718959 stress="-3.527381406647594 0.6762425081179441 -0.5285542007253221 0.6762425081179441 -4.010645037970911 -1.540204212599983 -0.5285542007253221 -1.540204212599983 -4.821440076285292" pbc="F F F" Fe 0.19019325 0.19877714 0.10881314 -5.66823048 -8.06309243 -13.09993434 Fe 1.63250256 1.60031152 0.12045968 4.38070203 3.32927099 -1.06567867 Fe 1.35431870 -0.21988289 1.63572127 7.17799508 -5.50623572 4.41718422 Fe 0.05791531 1.23387496 1.58501927 -5.89046664 10.24005716 9.74842879