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=50.802584128150365 stress="-6.96617462713222 0.5790310827745289 -0.37551946684759263 0.5790310827745289 -7.099651112250803 -0.7175615702918611 -0.37551946684759263 -0.7175615702918611 -7.915340473382294" pbc="T T T" Pd -0.14459490 0.11115480 0.11044915 21.28408957 -44.70058962 -13.68742413 Pd 1.70960170 1.31143450 -0.16166483 -33.66687973 35.45746458 5.99226552 Pd 1.28829595 0.03769167 1.64041416 -5.90804826 -26.86787747 -10.03144311 Pd -0.22187219 1.22744829 1.32834452 18.29083843 36.11100252 17.72660172