ATOM INFO

Atomic coordinates [Å]

MOLECULAR INFO

Charge / Multiplicity:

JOB |

Energies


Mulliken charges

Dipole moment (Debye)

Dipole moment

X Y Z Total
-0.2014 0.0421 -0.0970 0.2275

Quadrupole moment

XX YY ZZ XY XZ YZ
-65.6370 -132.8326 -130.1918 -22.1043 3.3249 0.3435

JOB |

Energies


Mulliken charges

Dipole moment (Debye)

Dipole moment

X Y Z Total
0.0785 0.0261 0.0986 0.1287

Quadrupole moment

XX YY ZZ XY XZ YZ
-68.2739 -132.0008 -130.0168 -22.0113 2.5207 -0.4561

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