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=2.743388305201917 stress="-0.5824818769527349 0.03198120882884489 -0.013555197025040612 0.03198120882884489 -0.7335461784479057 -0.049007255639061116 -0.013555197025040612 -0.049007255639061116 -0.5247872443347087" free_energy=2.743388305201917 pbc="F T F" Al 0.28187239 0.06281906 0.10170120 -5.09230357 -0.02778020 -5.14312899 Al 1.37793365 1.21904386 0.00082602 4.44206966 -0.95134223 -5.70289256 Al 1.74624097 0.05636285 1.35498893 6.70597073 0.21218884 5.18164134 Al 0.11042859 1.70947124 1.35512851 -6.05573682 0.76693360 5.66438020