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=35.51292240331543 stress="-10.719486748734058 -0.13045990928270482 0.8552803289939752 -0.13045990928270482 -3.2961439488678446 0.12146505125270342 0.8552803289939752 0.12146505125270342 -7.313700403396678" pbc="T F T" Cr -0.03149010 0.01229390 -0.15371586 -14.59918074 -27.59800683 115.85340149 Ni 1.36859499 1.74339277 -0.28843667 -5.52819801 26.60738135 42.59266448 Cr 1.41247317 0.15093924 1.64803915 13.23351539 -27.64998952 -121.61092462 Fe -0.20484213 1.64526935 1.53806039 6.89386336 28.64061500 -36.83514135