ATOM INFO

Atomic coordinates [Å]

MOLECULAR INFO

Charge / Multiplicity: 3 1

Full point group

Full point group C1 NOp 1

JOB |

Energies

Energy Value Units
SCF Done: -834.760616330 Eh

Energy Value Units
HF -834.7606163 Eh

Mulliken charges

Dipole moment (Debye)

Dipole moment

X Y Z Total
1.0960 -0.0011 1.0994 1.5524

Quadrupole moment

XX YY ZZ XY XZ YZ
-9.9183 -17.6088 -21.0986 0.0147 -0.0005 0.0140

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