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=2.4339233277999726 stress="-2.0060104261707856 -0.2268477399265747 -0.07532169129624215 -0.2268477399265747 -2.4979513832480262 0.4055874054575156 -0.07532169129624215 0.4055874054575156 -2.6422948749611113" pbc="F T T" Fe 0.07034430 0.04852473 0.01848935 -17.95811149 4.37944985 4.26572325 Fe 1.41561068 1.63661615 -0.09519967 19.01684242 -18.47593767 17.13182386 Fe 1.37719504 -0.20130994 1.61041876 22.14911835 23.82319057 -16.01428280 Fe 0.08611608 1.53369179 1.52598936 -23.20784928 -9.72670274 -5.38326431