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=0.8066160426908632 stress="-1.2835617685595786 0.1331833417411712 0.06428895532787436 0.1331833417411712 -1.533343995902374 0.42718124786617373 0.06428895532787436 0.42718124786617373 -1.4303751792576813" free_energy=0.8066160426908632 pbc="F F T" Fe 0.19273990 0.05332204 2.88436473 -8.95038598 -19.79710665 15.92810600 Fe 1.73110688 1.49816022 0.01283276 8.29242152 10.57071660 4.82632655 Fe 1.70071341 0.14720807 1.58942344 15.32850718 -14.47048832 -5.22116484 Fe 0.27559981 1.21321713 1.71736445 -14.67054273 23.69687837 -15.53326771