6 Lattice="5.248964892012194 3.817553969113515e-18 0.0 5.6265277320837e-20 3.5427733392101546 0.0 -1.6375770909626772e-17 0.0 21.341805962036666" Properties=species:S:1:pos:R:3 energy=-26.02386170265571 dipole="-4.716950879457821e-14 -5.2733862865329476e-14 4.2117822288821086e-08" free_energy=-26.030974638428663 pbc="T T F" Pt 2.62448245 0.00000000 9.75349256 Pt 0.00000000 1.77138667 11.58831416 S 2.62448245 1.77138667 11.29263287 S 0.00000000 -0.00000000 10.04917376 Br 2.62448245 1.77138667 7.91573460 Br 0.00000000 0.00000000 13.42607189