612 Lattice="17.18491086200487 0.0 0.0 -8.592455431002435 14.882569368267355 0.0 0.0 0.0 39.75569272672836" Properties=species:S:1:pos:R:3:forces:R:3 energy=-1418.8946855406755 stress="-52.39501991030458 16.981551849201644 0.034492993060177335 16.981551849201644 -22.19068035669934 -0.02224144100919875 0.034492993060177335 -0.02224144100919875 -0.0003017627211738589" pbc="T T F" Au 0.14397698 -0.05227853 -0.10444089 0.00000695 -0.00000457 -0.00000019 Au 2.97761240 -0.06788750 -0.15677434 0.00000694 -0.00000459 -0.00000017 Au 1.54917706 2.37062181 -0.04724202 0.00000697 -0.00000458 -0.00000008 Au -1.29792641 2.40848061 -0.01131857 0.00000696 -0.00000456 -0.00000014 Au 2.96994618 1.58640690 2.32625772 0.00000669 -0.00000436 -0.00000008 Au 5.84748035 1.56650329 2.33762892 0.00000667 -0.00000437 -0.00000003 Au 4.41375797 4.04011978 2.33538052 0.00000671 -0.00000438 0.00000003 Au 1.53625606 4.05283037 2.31248687 0.00000672 -0.00000436 -0.00000002 Au 5.83427198 3.20104610 4.71141910 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