KINISOT.py v 2.0.1: 2023-08-17 19:21 
  Found vibrational scaling factor 0.985 for RB3LYP/def2TZVPP level of theory 
  REF: I. M. Alecu, unpublished (2011). 

                                                     Temp = 226.15K / Vib. scale factor = 0.985 
                                                     V-ratio        ZPE        EXC       TRPF        KIE    1D-tunn   corr-KIE 
o Endo_TS1_G16_PCM_chloroform_def2tzvpp_v_02_reactant_solvated_2   -------------------------------------------------------------------------- 
o Endo_TS1_G16_PCM_chloroform_def2tzvpp_v_02_solvated_2      324.8 
o Endo_TS1_G16_PCM_chloroform_def2tzvpp_v_02_reactant_solvated_2: iso @ 13             9.779e+01  1.085e+00  2.698e+00 
o Endo_TS1_G16_PCM_chloroform_def2tzvpp_v_02_solvated_2: iso @ 13      311.9  4.413e+01  1.048e+00  2.812e+00 
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  KIE @ 226.15 K                                    1.041383   2.216061   1.035949   0.959715   2.294421   1.015024   2.328892 
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