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=-3.810518695329904 stress="-33.90877849176215 5.97234186494727 10.708680678969209 5.97234186494727 -23.49103406436559 -0.5819336787352078 10.708680678969209 -0.5819336787352078 -32.30308009509046" pbc="F F F" Fe -0.06786244 -0.04210664 -0.04844391 -2.11191528 -7.12185043 -8.66496982 Fe 1.27041603 1.69178619 0.17895518 8.56751367 8.86245669 -12.68419971 Fe 1.79140871 0.11455359 1.46999024 14.51771388 -10.62812284 0.99580768 Fe 0.14904689 1.05938083 1.60609294 -20.97331228 8.88751658 20.35336185