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=8.069503095777598 stress="-68.14318274756879 -8.97260121020233 -12.196475157198222 -8.97260121020233 -54.732362534902144 9.198097314692873 -12.196475157198222 9.198097314692873 -60.69189715352546" pbc="F F F" Fe 0.03369179 0.02598936 -0.27670350 -31.03365863 -19.51957944 -20.34613165 Fe 1.46375436 1.40583543 -0.24440284 19.85455098 29.05056718 -18.25359044 Fe 1.20178472 0.29874826 1.27290972 31.38657410 -25.76138089 33.46087810 Fe -0.11909813 1.36136659 1.55835534 -20.20746644 16.23039314 5.13884399