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=83.42214269122414 stress="-9.658246546766089 0.7347969328151828 -0.47461129226413995 0.7347969328151828 -9.838851953979143 -0.9290969824457291 -0.47461129226413995 -0.9290969824457291 -10.853970154355487" pbc="T T T" Au -0.14459490 0.11115480 0.11044915 26.81293720 -56.40846271 -17.40341918 Au 1.70960170 1.31143450 -0.16166483 -42.34638297 44.98440766 7.87185559 Au 1.28829595 0.03769167 1.64041416 -7.44360240 -34.20322347 -12.93196053 Au -0.22187219 1.22744829 1.32834452 22.97704817 45.62727852 22.46352413