ATOM INFO

Atomic coordinates [Å]

MOLECULAR INFO

Charge / Multiplicity:

JOB |

Energies


Spin

Mulliken atomic spin densities

S^2

S**2 before annihilation = 0.7568

Mulliken charges

Dipole moment (Debye)

Dipole moment

X Y Z Total
6.3143 28.3135 -9.9723 30.6752

Quadrupole moment

XX YY ZZ XY XZ YZ
-409.2384 1233.7233 844.3176 -28.1310 -298.1141 -1868.0926

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