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=36.01390021789361 stress="-93.4669764424333 27.721213856282976 2.3882794677978296 27.721213856282976 -80.61490233827007 4.69743692483722 2.3882794677978296 4.69743692483722 -67.85179813161328" pbc="F F F" Au 0.23171545 0.18190327 -0.17816502 -18.90722079 -17.11443124 -22.48430751 Au 1.71219253 1.42485375 0.12990665 24.32535100 24.35724509 -19.96803951 Au 1.28220450 0.28278197 1.56210000 49.55911392 -56.14951615 27.28418955 Au 0.13362859 1.32702941 1.57034430 -54.97724413 48.90670229 15.16815748