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| Total Energy, TE (eV) | −175539.349 |
| E HOMO (eV) | −4.0238 |
| E LUMO (eV) | −2.3507 |
| Gap, ΔE (eV) | 1.6731 |
| Dipole moment, μ (Debye) | 15.7142 |
| Ionization potential, I (eV) | 4.0238 |
| Electron affinity, A | 2.3507 |
| Electronegativity, χ | 3.1872 |
| Hardness, η | 0.8366 |
| Electrophilicity index, ω | 3.0715 |
| Softness, σ | 1.1954 |
| Fraction of electron transferred, ΔN | 2.2788 |
