3 Lattice="3.375290413268441 7.771102953185094e-19 0.0 6.365180728939081e-19 3.3752904604899907 0.0 1.4201930188261215e-18 0.0 18.620386719675125" Properties=species:S:1:pos:R:3:initial_magmoms:R:1 energy=-12.922568247620456 dipole="4.473806673865038e-16 -1.6219095594196506e-16 -1.390804537791517e-10" free_energy=-12.932351068217837 pbc="T T F" Pt 0.00000000 0.00000000 9.31019337 0.00000000 Se 0.00000000 1.68764523 11.04380483 0.00000000 Se 1.68764521 -0.00000000 7.57658189 0.00000000