ATOM INFO

Atomic coordinates [Å]

MOLECULAR INFO

Charge / Multiplicity: 0 1

JOB |

Energies

Energy Value Units
SCF Done: -2191.54371382 Eh

Energy Value Units
HF -2191.5437138 Eh

Spin

S^2

S**2 before annihilation = 1.0819

Dipole moment (Debye)

Dipole moment

X Y Z Total
0.0242 0.0001 -0.0138 0.0279

Quadrupole moment

XX YY ZZ XY XZ YZ
-277.9703 -292.8570 -317.2584 10.9383 -2.8134 -9.4340

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