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=2.9336252610347007 stress="-16.18446908773927 2.8714394968911083 -1.9604852400272783 2.8714394968911083 -17.091715625252338 1.7550343384232594 -1.9604852400272783 1.7550343384232594 -14.549739578739429" pbc="F F F" Fe -0.12320595 -0.04105180 0.20259391 -6.15522497 -3.75255820 -3.61130445 Fe 1.56504129 1.20865944 -0.13449789 4.06201713 3.84272242 -5.08380973 Fe 1.28802619 0.22277084 1.68584377 7.86357069 -8.44916306 7.13081264 Fe 0.18362810 1.69581920 1.64685009 -5.77036285 8.35899884 1.56430154