4
Lattice="4.411113679536667 3.395103912755644e-19 0.0 4.270307681723776e-19 4.411113751862088 0.0 9.139280912899287e-19 0.0 18.23333334" Properties=species:S:1:pos:R:3 energy=-27.065869964590128 dipole="-2.609412853519242e-15 3.3551639410999793e-15 1.2025364560416158e-10" free_energy=-27.077006481720364 pbc="T T F"
Zr       0.00000000      -0.00000000       9.11666666
Zr       2.20555684       2.20555688       9.11666668
S       -0.00000000       2.20555688       7.83470261
S        2.20555684       0.00000000      10.39863073