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=10760.554829509547 stress="-35364.06750695894 5388.795605657929 -3687.1654232959227 5388.795605657929 -49125.86369240695 579.3162533047871 -3687.1654232959227 579.3162533047871 -47241.135793882044" pbc="F F F" Nd 0.27169050 -0.05938251 -0.08117282 -14797.86398741 -12458.10916922 -16584.45933706 Nd 1.28707081 1.75145604 -0.04939996 13046.45738914 12927.06176061 -10457.12236367 Nd 1.27592323 -0.05788742 1.68238868 19310.54846366 -16031.90463172 15957.50342695 Nd 0.11651966 1.59461032 1.67191385 -17559.14186539 15562.95204033 11084.07827377