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=-7.14016957629 stress="-1.077952626753767 0.25216754658178914 0.19864867643226694 0.25216754658178914 -1.4453482412797674 0.703207581029254 0.19864867643226694 0.703207581029254 -2.225128257275982" pbc="F F F" Fe -0.25354363 -0.01806569 -0.07998135 -0.89356353 -1.39521612 -1.16203506 Fe 1.70070203 1.20342959 -0.09914834 1.70683968 3.36758533 -6.00199802 Fe 1.49793547 0.28187239 1.51001192 1.55579896 -4.88787666 5.95405002 Fe -0.01546661 1.60170120 1.37793365 -2.36907511 2.91550746 1.20998306