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=-2.049526962730209 stress="-19.82649588521678 1.1520068346665095 -2.0346287076788077 1.1520068346665095 -15.393443394911461 0.26891646687855086 -2.0346287076788077 0.26891646687855086 -19.65775372532663" pbc="F F F" Al 0.04852473 0.05473499 -0.08438932 -7.37168117 -4.72264825 -8.51919885 Al 1.63661615 1.40480033 -0.12280496 4.26774435 6.22060930 -4.75880218 Al 1.29869006 0.11041876 1.26735611 9.36932675 -7.75631957 8.48924370 Al -0.16466555 1.24148635 1.58611608 -6.26538993 6.25835853 4.78875734