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=15.933826851565643 stress="-4.099906194638378 0.5990673831900433 -0.2516019264020344 0.5990673831900433 -3.066149704218073 -0.11031128581419809 -0.2516019264020344 -0.11031128581419809 -2.7502737571218514" pbc="T F F" Pd -0.06254558 0.09073906 0.27219963 -7.30125342 -30.79200879 -33.66096126 Pd 1.43381326 1.63132919 0.25978669 6.76002923 20.48252038 -23.45114298 Pd 1.22592512 0.18365717 1.70288723 24.49340752 -34.89198333 26.72157106 Pd 0.08343331 1.29585403 1.44809454 -23.95218334 45.20147173 30.39053319