4 Lattice="4.010748259819489 3.292524806811193e-19 0.0 -2.005374127618741 3.4751568680757314 0.0 3.3581945238676083e-18 0.0 18.85580293064" Properties=species:S:1:pos:R:3 energy=-24.614886885160992 pbc="T T F" Cl -0.00056439 0.00033976 7.48326321 Cl 0.00056461 2.31643149 11.37376370 Nb 0.00003148 0.00019530 10.07002230 Nb -0.00003173 2.31657597 8.78716931