ATOM INFO

Atomic coordinates [Å]

MOLECULAR INFO

Charge / Multiplicity: 1 1

Full point group

Full point group C1 NOp 1

JOB |

Energies

Energy Value Units
SCF Done: -1124.52168892 Eh

Energy Value Units
HF -1124.5216889 Eh

Mulliken charges

Dipole moment (Debye)

Dipole moment

X Y Z Total
-4.0017 1.7791 -0.0318 4.3794

Quadrupole moment

XX YY ZZ XY XZ YZ
-85.2230 -114.2359 -137.4343 7.9828 3.7373 -2.5296

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