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=-8.284566230208897 stress="-11.45204713605027 1.0418931357748595 -1.6080777824377526 1.0418931357748595 -12.74082429070413 -3.8443827919599745 -1.6080777824377526 -3.8443827919599745 -12.004171771072972" pbc="F F F" Au -0.14459490 0.11115480 0.11044915 -4.22167356 -6.07950732 -6.81220428 Au 1.70960170 1.31143450 -0.16166483 3.15879732 1.82178245 -1.72911131 Au 1.28829595 -0.16490224 1.64041416 3.75928476 -2.70884444 3.62492070 Au -0.22187219 1.51878885 1.32834452 -2.69640852 6.96656931 4.91639489