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=5.491403254811749 stress="-52.46846522234433 18.37930390225645 2.448409209894301 18.37930390225645 -44.84060553176906 2.733764219803952 2.448409209894301 2.733764219803952 -41.44115500256736" pbc="F F F" Pd 0.23171545 0.18190327 -0.17816502 -9.24686215 -8.54939280 -13.46902939 Pd 1.71219253 1.42485375 0.12990665 12.75867641 12.46118186 -12.51294735 Pd 1.28220450 0.28278197 1.56210000 28.93589710 -32.39793966 16.21591827 Pd 0.13362859 1.32702941 1.57034430 -32.44771136 28.48615060 9.76605846