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=-1.7052183612213079 stress="-1.6072299276017663 0.20687290528245617 -0.34344154645403757 0.20687290528245617 -1.6301580536076226 -0.12821271734118728 -0.34344154645403757 -0.12821271734118728 -1.3751633330075346" pbc="T T F" Fe 0.18584377 0.18362810 0.19581920 -8.91530000 -3.56309767 -19.17662387 Fe 1.64685009 1.68811563 0.17626233 1.95196773 0.64384349 -9.64951351 Fe 1.35402479 0.20996341 1.49207130 15.26237244 -6.10498578 16.43724238 Fe 0.15300231 1.53848316 1.45774659 -8.29904018 9.02423996 12.38889500