4 Lattice="2.94934212269426 0.0 0.0 1.47467106134713 2.55420520270475 0.0 0.0 0.0 14.81625463123649" Properties=species:S:1:pos:R:3:tags:I:1:forces:R:3:magmoms:R:1 energy=-11.602857485528482 magmom=0.0 pbc="T T F" Au 1.47467106 0.85140173 4.99999956 3 -0.00000000 0.00000000 -0.13133081 0.00000000 Au 0.00000000 1.70280347 7.40812732 2 0.00000000 -0.00000000 0.22365164 0.00000000 Au -0.00000000 0.00000000 9.86336672 1 0.00000000 0.00000000 -0.09550577 0.00000000 H 0.00000000 0.00000000 11.46196898 0 0.00000000 0.00000000 0.00327891 0.00000000