ATOM INFO

Atomic coordinates [Å]

MOLECULAR INFO

Charge / Multiplicity:

JOB |

Energies


Mulliken charges

Dipole moment (Debye)

Dipole moment

X Y Z Total
7.2766 1.7675 -0.1338 7.4893

Quadrupole moment

XX YY ZZ XY XZ YZ
-178.7993 -155.7878 -171.4168 4.9593 0.7577 -0.4230

JOB |

Energies


Mulliken charges

Dipole moment (Debye)

Dipole moment

X Y Z Total
7.9073 -0.0011 -0.0002 7.9073

Quadrupole moment

XX YY ZZ XY XZ YZ
-174.2298 -154.0426 -173.9344 0.0006 -0.0022 -3.4127

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