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=83.42210620883499 stress="-9.658537383088001 0.7347312451458199 -0.47467914832238456 0.7347312451458199 -9.83932351841095 -0.9291807242833046 -0.47467914832238456 -0.9291807242833046 -10.854342813628044" pbc="T T T" Au -0.14459490 0.11115480 0.11044915 26.81504629 -56.41014944 -17.40422670 Au 1.70960170 1.31143450 -0.16166483 -42.34649410 44.98690107 7.87159113 Au 1.28829595 0.03769167 1.64041416 -7.44608634 -34.20609491 -12.93264072 Au -0.22187219 1.22744829 1.32834452 22.97753416 45.62934328 22.46527630