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=-8.332766701857977 stress="-3.9455295224554074 0.44409861675480533 -0.14024753053714925 0.44409861675480533 -4.04690644227171 0.09048030191510129 -0.14024753053714925 0.09048030191510129 -2.092032355962577" pbc="T T F" Mn -0.27997518 -0.00220281 0.22586561 7.67618560 -14.33443325 -20.76171836 Mn 1.79391194 1.22614529 0.02103145 -8.79912980 12.71795718 -25.32431531 Mn 1.27761356 0.18220204 1.39362841 6.81432743 -12.97635049 24.77497523 Mn 0.23573857 1.31709137 1.27538150 -5.69138324 14.59282655 21.31105845