ATOM INFO

Atomic coordinates [Å]

MOLECULAR INFO

Charge / Multiplicity:

JOB |

Energies


Mulliken charges

Dipole moment (Debye)

Dipole moment

X Y Z Total
-33.5611 5.0338 3.5321 34.1199

Quadrupole moment

XX YY ZZ XY XZ YZ
-707.1590 -768.7194 -792.6811 -18.1943 -9.8255 4.9112

JOB |

Energies


Mulliken charges

Dipole moment (Debye)

Dipole moment

X Y Z Total
-25.5008 3.3993 2.4744 25.8451

Quadrupole moment

XX YY ZZ XY XZ YZ
-714.4920 -762.3475 -794.1807 -20.3311 -5.9639 2.9918

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