10 Lattice="6.517074 -0.005958 0.0 -3.263697 5.642225 -0.0 0.0 -0.0 4.607421" Properties=species:S:1:pos:R:3:initial_charges:R:1 energy=-967.679505396 dipole="-0.66853601 -1.15550727 0.11306176" pbc="T T T" Ta -0.00490000 3.75980000 3.45560000 0.00000000 Ta 3.25830000 1.87650000 1.15190000 0.00000000 Ag 0.00000000 -0.00000000 2.30370000 0.00000000 Ag 0.00000000 0.00000000 0.00000000 0.00000000 S -0.84350000 5.15890000 1.15190000 0.00000000 S -0.79710000 2.32740000 1.15190000 0.00000000 S 1.63490000 3.78140000 1.15190000 0.00000000 S 4.09690000 0.47730000 3.45560000 0.00000000 S 4.05050000 3.30890000 3.45560000 0.00000000 S 1.61850000 1.85490000 3.45560000 0.00000000