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Table 3

Rotational and vibrational partition functions at various temperatures for the sp conformation of MAAN.

Temperature (K) Q(T)rot Q(T)vib

300 72 581.26 5.463
200 39 508.23 2.437
150 25 661.35 1.686
50 4938.53 1.018
10 441.72 1.000

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