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=5.718292950874057 stress="-59.343492525882446 16.39538550057489 -14.641987300270259 16.39538550057489 -53.435358625490515 -11.55857090708598 -14.641987300270259 -11.55857090708598 -59.17071356802815" pbc="F F F" Fe 0.18584377 0.18362810 0.19581920 -21.72250650 -16.82490353 -35.74015656 Fe 1.64685009 1.76959405 0.17626233 10.94010100 6.96315430 -10.28353155 Fe 1.35402479 0.20996341 1.49207130 36.39735856 -21.85198389 25.95936172 Fe 0.15300231 1.53848316 1.45774659 -25.61495306 31.71373312 20.06432639