KINISOT.py v 2.0.1: 2023-08-16 12:42 
  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  REF: I. M. Alecu, unpublished (2011).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_01_reactant_EWG   -------------------------------------------------------------------------- 
o Endo_TS1_G16_PCM_chloroform_def2tzvpp_v_02_EWG       608.4 
o Endo_TS1_G16_PCM_chloroform_def2tzvpp_v_01_reactant_EWG: iso @ 14             1.078e+02  1.076e+00  2.694e+00 
o Endo_TS1_G16_PCM_chloroform_def2tzvpp_v_02_EWG: iso @ 14      585.7  8.822e+01  1.048e+00  2.800e+00 
                                                    -------------------------------------------------------------------------- 
  KIE @ 226.15 K                                    1.038642   1.222362   1.026465   0.962183   1.253914   1.064455   1.334735 
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