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=83.7409389502125 stress="-7.508368086516769 -0.6196788755523586 -0.1941529053266096 -0.6196788755523586 -11.64997625726959 -2.216812264371004 -0.1941529053266096 -2.216812264371004 -12.344230161430865" pbc="F T T" Au 0.24624097 0.30733484 -0.14501107 -75.12131307 -42.03548472 -55.12048288 Au 1.61042859 1.70947124 -0.14487149 72.21013900 -39.99139791 -58.25937983 Au 1.55280714 -0.08666117 1.16081220 74.74230087 56.35555132 68.01283859 Au 0.15488783 1.54832605 1.20245745 -71.83112680 25.67133130 45.36702412