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=113.80231400276637 stress="-15.164775592994365 0.006748390609622385 0.3409252244571303 0.006748390609622385 -15.91762001635454 -2.356980733930009 0.3409252244571303 -2.356980733930009 -15.004644695706496" pbc="T T T" Pt 0.00082602 0.24624097 0.14302402 -45.04137970 -91.07313422 -115.12908244 Pt 1.35498893 1.61042859 0.20947124 55.12721730 25.12894175 -89.14094770 Pt 1.35512851 0.05280714 1.41333883 46.50461158 -25.63738148 76.16471606 Pt 0.00144273 1.37241235 1.32230844 -56.59044918 91.58157394 128.10531409