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=-4.263695949402021 stress="-29.175843878627397 -1.0642344109489676 -0.5995575380633511 -1.0642344109489676 -26.949456781517316 -1.901536869478205 -0.5995575380633511 -1.901536869478205 -27.406917802291048" pbc="F F F" Au 0.26959405 0.17626233 -0.14597521 -8.69511709 -10.68122012 -13.57750393 Au 1.70996341 1.49207130 0.15300231 11.47322879 10.64222358 -6.02621321 Au 1.53848316 -0.04225341 1.41852158 7.45558234 -9.01710432 9.73688590 Au -0.04210664 1.38825682 1.27041603 -10.23369404 9.05610086 9.86683125