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=-1.7052182337186927 stress="-1.6072290679062877 0.20687703384642994 -0.34344525827417494 0.20687703384642994 -1.630136799743197 -0.12823127463777662 -0.34344525827417494 -0.12823127463777662 -1.3751467227895349" pbc="T T F" Fe 0.18584377 0.18362810 0.19581920 -8.91530121 -3.56309677 -19.17662528 Fe 1.64685009 1.68811563 0.17626233 1.95189273 0.64346183 -9.64917133 Fe 1.35402479 0.20996341 1.49207130 15.26244735 -6.10460465 16.43690031 Fe 0.15300231 1.53848316 1.45774659 -8.29903887 9.02423959 12.38889629