KINISOT.py v 2.0.1: 2023-09-29 07:04 
                                                      Unable to find vibrational scaling factor for RB3LYP/def2QZVPP; using value of 1.0 

                                                     Temp = 195.15K / Vib. scale factor = 1.0 
                                                     V-ratio        ZPE        EXC       TRPF        KIE    1D-tunn   corr-KIE 
o endo_react                                        -------------------------------------------------------------------------- 
o endo_TS1                                             569.0 
o endo_react: iso @ 14                                        2.472e+02  1.066e+00  2.683e+00 
o endo_TS1: iso @ 14                                   545.8  1.914e+02  1.037e+00  2.800e+00 
                                                    -------------------------------------------------------------------------- 
  KIE @ 195.15 K                                    1.042596   1.291577   1.028273   0.958050   1.326579   1.090688   1.446884 
                                                    --------------------------------------------------------------------------
 KIE  5.573243 /1.446884 = 3.851893448265376