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=-0.844264409033457 stress="-23.57161845119974 2.036673803671459 3.8243370276026987 2.036673803671459 -29.53029721994095 11.917219570045189 3.8243370276026987 11.917219570045189 -31.44238210599587" pbc="F F F" Fe -0.20130994 0.11041876 -0.23264389 -5.58112937 -6.00796652 -4.76000357 Fe 1.33533445 1.24148635 0.08611608 10.22060488 18.33131930 -21.26024561 Fe 1.53369179 0.02598936 1.22329650 5.49830518 -17.94418459 15.63762050 Fe -0.03624564 1.40583543 1.25559716 -10.13778069 5.62083180 10.38262867