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=-4.442528110736495 stress="-28.999143208731766 0.5933608620682946 -2.201033443950829 0.5933608620682946 -25.928430347718088 0.5388783539008344 -2.201033443950829 0.5388783539008344 -27.344268144288954" pbc="F F F" Au -0.14801295 -0.02432459 0.06329927 -11.81905856 -7.81246394 -10.89308503 Au 1.43745442 1.27846858 -0.00548572 7.98950138 9.73334132 -8.42848305 Au 1.34126820 -0.15859300 1.31668137 11.30720626 -11.18251384 10.02714765 Au -0.08013605 1.24396547 1.59073906 -7.47764909 9.26163647 9.29442043