4 Lattice="3.5271 0.0 0.0 0.0 3.5271 0.0 0.0 0.0 6.12112" Properties=species:S:1:pos:R:3:forces:R:3 energy=-22.717959941073236 stress="-0.0027311531822163553 0.0 0.0 0.0 -0.002731153182199425 0.0 0.0 0.0 -0.002827606851746554" dipole="-1.2548209811748957e-15 -3.9607971547236835e-16 3.37920247031189e-15" pbc="T T T" Pt 0.00000000 1.76355000 0.00000000 0.00000000 0.00000000 0.00000000 Pt 1.76355000 0.00000000 3.06056000 0.00000000 0.00000000 0.00000000 S 0.00000000 0.00000000 1.53028000 0.00000000 0.00000000 0.00000000 S 0.00000000 0.00000000 4.59084000 0.00000000 0.00000000 -0.00000000