3 Lattice="3.373485346141282 4.9525075629927543e-20 0.0 -1.686742673070641 2.9215240090528902 0.0 2.7275254609999716e-19 0.0 17.59416023279923" Properties=species:S:1:pos:R:3 energy=-10.984250565393825 dipole="2.542090361287578e-15 -3.5035508782638053e-16 -8.622172818160531e-16" free_energy=-10.99787178403155 pbc="T T F" Cu 0.00000000 0.00000000 8.79708012 S 1.68674267 0.97384134 10.08219421 S -0.00000000 1.94768267 7.51196602