3 Lattice="3.808463578674871 -6.429131120928802e-19 0.0 1.8093783161168283e-18 3.8084635786748757 0.0 6.760329970715317e-18 0.0 18.705239533417508" Properties=species:S:1:pos:R:3:initial_magmoms:R:1 energy=-10.355379552335442 dipole="-2.3415908083016887e-15 -1.3782536767716456e-16 -3.5134777228245066e-14" free_energy=-10.361171438283252 pbc="T T F" In 0.00000000 0.00000000 9.35261977 0.00000000 Se 0.00000000 1.90423179 11.11288405 0.00000000 Se 1.90423179 -0.00000000 7.59235549 0.00000000