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=3.5402583042472013 stress="-35.57323781853095 0.9986330512675978 -4.328626862303471 0.9986330512675978 -34.85267252205123 0.9855968117319165 -4.328626862303471 0.9855968117319165 -35.83844214968657" pbc="F F F" Pd -0.14801295 -0.02432459 0.06329927 -15.02078957 -10.32627379 -14.74501885 Pd 1.43745442 1.27846858 -0.00548572 9.16869591 13.10659765 -10.70704481 Pd 1.34126820 -0.15859300 1.31668137 14.52039257 -15.18920193 13.77278140 Pd -0.08013605 1.24396547 1.59073906 -8.66829891 12.40887807 11.67928226