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=12.716092679769877 stress="-80.26752344598358 23.387318303826394 -7.8944616227514 23.387318303826394 -90.70696227311531 5.822856384057118 -7.8944616227514 5.822856384057118 -68.03456193343717" pbc="F F F" Au -0.12320595 -0.04105180 0.20259391 -27.25353881 -17.39937853 -17.11071034 Au 1.56504129 1.20865944 -0.13449789 18.58096084 16.35834202 -23.62079623 Au 1.28802619 0.22277084 1.68584377 41.86644819 -46.47207371 31.93992523 Au 0.18362810 1.69581920 1.64685009 -33.19387022 47.51311022 8.79158133