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:Z:I:1:forces:R:3 energy=80.2036219097 pbc="F T T" Au -0.25271761 -0.01806569 0.16625962 79 -36.63336224 -10.62803213 -29.14655597 Au 1.70070203 1.20342959 -0.09914834 79 47.25219411 69.71060564 -14.21761681 Au 1.49793547 0.42489640 1.36500085 79 54.38468947 -101.47798983 17.55488129 Au 0.09496198 1.45682971 1.43074079 79 -65.00352134 42.39541632 25.80929148