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=24.22649642193923 stress="-5.474367047021392 0.7368948104738765 -0.3035905837864921 0.7368948104738765 -3.900425225960354 -0.11821878346212021 -0.3035905837864921 -0.11821878346212021 -3.4904665633824066" pbc="T F F" Au -0.06254558 0.09073906 0.27219963 -8.72763641 -39.33921214 -42.59063698 Au 1.43381326 1.63132919 0.25978669 8.12751522 26.81339261 -29.81079304 Au 1.22592512 0.18365717 1.70288723 29.79737286 -43.97421176 34.28702917 Au 0.08343331 1.29585403 1.44809454 -29.19725167 56.50003129 38.11440084