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=5.34321631871 stress="-12.081272513884699 1.0109425117776774 -2.3952454320197156 1.0109425117776774 -11.804993608039561 -2.6260069759323095 -2.3952454320197156 -2.6260069759323095 -16.531283636097438" pbc="F F F" Fe 0.02031036 0.40725872 0.02015752 -29.39119732 -14.69804921 -42.67375829 Fe 1.37970777 1.77711528 0.17848773 17.99815083 14.29106453 -7.58675438 Fe 1.25213077 -0.26874888 1.21824351 25.40663752 -21.51016944 13.64237243 Fe 0.13616082 1.26429260 1.62968218 -14.01359102 21.91715411 36.61814023