3 Lattice="3.1204865824958206 5.4866077347756925e-19 0.0 -2.5887984651858588e-18 3.12048642710432 0.0 7.980600444161399e-17 0.0 18.761808075912434" Properties=species:S:1:pos:R:3 energy=-16.162001423918937 pbc="T T F" Nb 0.00000000 -0.00000000 9.38090323 Cl -0.00000000 1.56024321 11.27519855 Cl 1.56024329 0.00000000 7.48660797