KINISOT.py v 2.0.1: 2023-08-25 14:04 
  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  REF: I. M. Alecu, unpublished (2011).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_EDG_stretched   -------------------------------------------------------------------------- 
o Endo_TS1_G16_PCM_chloroform_def2tzvpp_v_02_EDG       768.4 
o Endo_TS1_G16_PCM_chloroform_def2tzvpp_v_01_reactant_EDG_stretched: iso @ 13             8.061e+01  1.086e+00  2.456e+00 
o Endo_TS1_G16_PCM_chloroform_def2tzvpp_v_02_EDG: iso @ 13      672.2  1.993e+01  1.034e+00  2.800e+00 
                                                    -------------------------------------------------------------------------- 
  KIE @ 226.15 K                                    1.143133   4.044475   1.050063   0.877327   4.259276   1.501102   6.393607 
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