3 Lattice="3.547392311830623 0.0 0.0 -1.7736961559153115 3.0721318592349283 0.0 0.0 -0.0 18.6102" Properties=species:S:1:pos:R:3 energy=-18.51337752553299 dipole="5.759734515116953 -3.325384272763544 -3.266615155484621e-14" free_energy=-18.513378044593367 pbc="T T F" Mo 0.00000000 0.00000000 9.30510000 Te 1.77369616 1.02404395 11.11020000 Te 1.77369616 1.02404395 7.50000000