ATOM INFO

Atomic coordinates [Å]

MOLECULAR INFO

Charge / Multiplicity: 2 1

Full point group

Full point group C1 NOp 1

JOB |

Energies

Energy Value Units
SCF Done: -890.941073037 Eh

Energy Value Units
HF -890.941073 Eh

Mulliken charges

Dipole moment (Debye)

Dipole moment

X Y Z Total
3.5320 -0.3340 0.7282 3.6217

Quadrupole moment

XX YY ZZ XY XZ YZ
-36.8955 -30.3875 -29.3512 1.9652 -0.6726 0.0591

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