16 Lattice="6.0 0.0 0.0 0.0 6.0 0.0 0.0 0.0 6.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=-31.9235822881923 stress="-53.23809446824577 -25.76887263264551 -19.513166860900796 -25.76887263264551 -55.91179564113156 -10.500816153423703 -19.513166860900796 -10.500816153423703 -45.231921308256574" pbc="F F F" Pd -0.12633864 0.23809202 -0.21780693 2.10502864 1.41243862 1.68549466 Pd 1.71813893 1.26716069 1.69410236 -8.58658196 -0.46589443 -3.19583211 Pd 2.70967615 0.01817279 0.06268810 0.14178320 -4.09627926 -5.55777308 Pd 4.22002482 1.27696427 1.41661558 8.06768476 -2.12524056 3.91837132 Pd -0.03487808 3.22586561 0.29391194 -13.99781044 -16.31652899 -11.50138104 Pd 1.22614529 4.52103145 1.27761356 16.60451480 15.17162075 10.78668699 Pd 3.18220204 2.89362841 0.23573857 -11.95850778 -2.79311715 -9.89343267 Pd 4.52724172 4.27538150 1.20296332 7.02536440 7.43480151 6.92980764 Pd -0.15112699 0.44063820 3.08962620 -2.18922646 -1.80172636 -0.04227352 Pd 1.67279236 1.42299150 4.40698366 -3.00882763 -3.20023781 7.49405997 Pd 3.13568052 -0.09846742 3.13102478 1.31951164 -2.92527504 1.46587701 Pd 4.47421109 1.91841162 4.27758598 3.73880491 -2.78750403 2.75462064 Pd 0.25226748 2.96431997 2.92904101 -2.48926544 1.76370532 1.81518041 Pd 1.87004596 4.70379337 4.73854596 0.67650679 -1.78145727 -1.79738237 Pd 2.76922180 2.78229695 3.00304726 4.96829419 13.63641230 -3.36458132 Pd 4.68745344 4.52015752 4.37970777 -2.41727361 -1.12571760 -1.49744254