7 Lattice="0.0 -3.836199 0.0 0.050606 0.0 3.992986 -6.479226 1.9181 -0.002751" Properties=species:S:1:pos:R:3:forces:R:3 energy=-65.63211125842064 stress="0.005347416020309796 -0.00010364351969418516 -0.0004542703763776401 -0.00010364351969418516 0.0033055428731069976 6.854888809315639e-06 -0.0004542703763776401 6.854888809315639e-06 0.02597854344058238" dipole="-2.287365963258967e-06 -1.29465579924706e-05 -0.0002463066807974332" pbc="T T T" Nb -1.89177000 -0.00000000 0.26003000 0.10214477 -0.00161120 0.66102285 Nb -4.53685000 -1.91810000 3.73021000 -0.10214476 0.00161212 -0.66102735 O 0.00000000 0.00000000 0.00000000 -0.00000751 -0.00000098 0.00001383 O -1.89638000 -0.00000000 2.06218000 0.02189995 -0.00051606 -0.87729828 O -2.39129000 -1.91810000 0.00141000 0.02748690 0.00169992 0.12335273 O -4.03733000 -0.00000000 3.98883000 -0.02748223 -0.00169929 -0.12335174 O -4.53224000 -1.91810000 1.92806000 -0.02189718 0.00051552 0.87728771