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=-2.0865740816542804 stress="-6.367486790312506 -0.05870129301859425 0.1729780416123218 -0.05870129301859425 -5.950405752098163 0.07383184155091876 0.1729780416123218 0.07383184155091876 -6.49543373192336" pbc="T T T" Mn 0.16431082 -0.18574270 -0.01155935 -6.55207664 10.88886965 1.77152879 Mn 1.53277713 1.39971974 -0.12633864 -0.35720417 -8.73938936 3.75038373 Mn 1.34298871 -0.21780693 1.71813893 3.85578847 10.80799088 -9.52495164 Mn -0.23283931 1.69410236 1.26397090 3.05349234 -12.95747117 4.00303912