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=16.23565616103124 stress="-80.57227405632742 27.17409860528936 2.1374276604893225 27.17409860528936 -69.72336942741185 4.634615126961094 2.1374276604893225 4.634615126961094 -56.03585893143182" pbc="F F F" Au 0.23171545 0.18190327 -0.17816502 -15.15177914 -13.59237420 -18.25950364 Au 1.71219253 1.42485375 0.12990665 19.62166082 20.00304424 -16.86819865 Au 1.28220450 0.28278197 1.56210000 44.47630998 -49.98968631 22.88148276 Au 0.13362859 1.32702941 1.57034430 -48.94619166 43.57901628 12.24621953