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=-167.49385752997367 stress="40.56830118118419 -13.18739104416414 -7.644555086561208 -13.18739104416414 30.346584259309978 -0.7315617467200424 -7.644555086561208 -0.7315617467200424 25.355733338807468" pbc="T T F" Pd 0.18883157 -0.00044125 0.04313966 238.32921230 -147.64361467 236.07754270 Pd 1.44832183 1.75980354 0.27143892 -560.41988186 182.81591035 363.47289778 Pd 1.40295338 0.09041343 1.74759167 -106.37304547 40.61257757 -91.88243152 Pd 0.11018303 1.42518197 1.24663523 428.46371504 -75.78487325 -507.66800896