3a-4 in thf with Li ions, amine with PT NHN and extra amine, GS, G = -1297.194873, ==> Def2-TZVPP, G = -1298.715994
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Gaussian 16 (C01) calculation. G = -1298.731417 @339K
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2022-10-25

Gaussian 16 (C01) calculation. G = -1298.731417 @339K