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Singlet state calculation

Number of electrons = 30
Number of Double Occupied Levels = 15
Charge on the System = 0
Total Orbitals = 25
ENERGIES AND GRADIENT
Total Energy = -27065.6931732 (kcal/mol)
Total Energy = -43.131922224 (a.u.)
Binding Energy = -932.5067532 (kcal/mol)
Isolated Atomic Energy = -26133.1864200 (kcal/mol)
Electronic Energy = -81704.6603446 (kcal/mol)
Core-Core Interaction = 54638.9671714 (kcal/mol)
Heat of Formation = -98.0987532 (kcal/mol)
Gradient = 0.0994342 (kcal/mol/Ang)

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