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=0.45678138937961565 stress="-9.895448134667367 -0.07853342562992105 -0.10431860596561027 -0.07853342562992105 -9.243089149779358 -0.151999863792744 -0.10431860596561027 -0.151999863792744 -9.259670681009188" pbc="F F F" Al 0.26959405 0.17626233 -0.14597521 -2.80344972 -3.35193545 -4.38724241 Al 1.70996341 1.49207130 0.15300231 3.80432433 3.66803816 -2.26883073 Al 1.53848316 -0.04225341 1.41852158 2.59639955 -3.35528281 3.44616640 Al -0.04210664 1.38825682 1.27041603 -3.59727416 3.03918010 3.20990675