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=-6.00240356354 stress="-0.394349738729097 -0.0768583008278824 -0.045541134828447793 -0.0768583008278824 -0.36425300335755734 0.06092859375088185 -0.045541134828447793 0.06092859375088185 -0.3720711428185291" pbc="F F F" Al -0.02432459 0.06329927 -0.06254558 -0.95035550 -0.52574411 -0.52064203 Al 1.27846858 1.49451428 -0.02740261 0.74171845 0.78529628 -0.51242752 Al 1.34140700 -0.18331863 1.41986395 0.58521035 -0.50367931 0.62890168 Al 0.00375216 1.59073906 1.77219963 -0.37657330 0.24412713 0.40416788