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=1.4369756177674897 stress="-48.63260461917144 -0.22287089091277856 22.927366058660674 -0.22287089091277856 -26.101992170772295 -5.056099270192009 22.927366058660674 -5.056099270192009 -38.3168321925812" pbc="F F F" Fe -0.05809009 0.20384132 -0.20775377 -4.45859848 -11.25725652 -10.69992160 Fe 1.23214964 1.50041025 0.25551247 32.01475217 8.58774960 -22.07950543 Ni 1.25840170 -0.00811119 1.56482696 3.32000808 -7.50735016 6.15902744 Ni -0.15379940 1.51821382 1.20575425 -30.87616177 10.17685708 26.62039959