KINISOT.py v 2.0.1: 2023-09-28 16:13 
                                                      Unable to find vibrational scaling factor for RB3LYP/def2QZVPP; using value of 1.0 

                                                     Temp = 226.15K / Vib. scale factor = 1.0 
                                                     V-ratio        ZPE        EXC       TRPF        KIE    1D-tunn   corr-KIE 
o endo_react                                        -------------------------------------------------------------------------- 
o endo_TS1                                             764.5 
o endo_react: iso @ 14                                        8.827e+01  1.072e+00  2.737e+00 
o endo_TS1: iso @ 14                                   748.0  8.789e+01  1.051e+00  2.798e+00 
                                                    -------------------------------------------------------------------------- 
  KIE @ 226.15 K                                    1.022064   1.004271   1.019661   0.978241   1.023837   1.083104   1.108922 
                                                    --------------------------------------------------------------------------
  KIE = 6.614851 / 1.108922 = 5.965118376224838