ATOM INFO

Atomic coordinates [Å]

MOLECULAR INFO

Charge / Multiplicity: 0 1

Full point group

Full point group C1 NOp 1

JOB |

Energies

Energy Value Units
SCF Done: -802.700524987 Eh

Energy Value Units
HF -802.700525 Eh

Mulliken charges

Dipole moment (Debye)

Dipole moment

X Y Z Total
4.2400 2.0003 -0.6621 4.7347

Quadrupole moment

XX YY ZZ XY XZ YZ
-72.2817 -63.3959 -65.7922 -5.0309 1.3455 0.3839

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