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155: C6H9O3NNi, Optimize + Vib Freq - Gaussian

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Route #N B3LYP/6-31G(d) OPT FREQ Geom=Connectivity
Stoichiometry C6H9NNiO3
Symmetry C1
Basis 6-31G(d)
RB3LYP Energy -2022.69287944 Hartree
ZPE 0.147557 Hartree
Conditions 298.150K, 1.00000 atm
Internal Energy -2022.530755 Hartree
Enthalpy -2022.529810 Hartree
Free Energy -2022.588486 Hartree
Cv 48.525 cal/mol-K
Entropy 123.492 cal/mol-K
Dipole Moment 5.1946 Debye
Server localhost (9415)
CPU time 35889.6 sec