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=80.22844548287044 stress="-9.979888891124297 0.004884011978379469 0.1215876275348038 0.004884011978379469 -10.216609953143006 -0.8461396080202124 0.1215876275348038 -0.8461396080202124 -9.692254272047682" pbc="T T T" Au 0.00082602 0.24624097 0.14302402 -19.94708562 -37.75744603 -48.37041239 Au 1.35498893 1.61042859 0.20947124 23.47646133 11.27412564 -40.22850577 Au 1.35512851 0.05280714 1.41333883 20.47137738 -11.68008623 34.66410485 Au 0.00144273 1.37241235 1.32230844 -24.00075309 38.16340662 53.93481331