ATOM INFO

Atomic coordinates [Å]

MOLECULAR INFO

Charge / Multiplicity: 0 1

JOB |

Energies


Spin

Mulliken atomic spin densities

S^2

S**2 before annihilation = 0.0000

Mulliken charges

Dipole moment (Debye)

Dipole moment

X Y Z Total
-0.9143 1.2504 -1.3735 2.0703

Quadrupole moment

XX YY ZZ XY XZ YZ
-281.2250 -255.5096 -256.2991 9.1054 12.3100 -1.2757

JOB |

Energies


Spin

Mulliken atomic spin densities

S^2

S**2 before annihilation = 0.0000

Mulliken charges

Dipole moment (Debye)

Dipole moment

X Y Z Total
-0.9143 1.2504 -1.3735 2.0703

Quadrupole moment

XX YY ZZ XY XZ YZ
-281.2250 -255.5096 -256.2991 9.1055 12.3100 -1.2757

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