KINISOT.py v 2.0.1: 2023-09-28 16:03 
                                                      Unable to find vibrational scaling factor for RB3LYP/def2QZVPP; using value of 1.0 

                                                     Temp = 250.15K / 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 @ 13                                        6.031e+01  1.082e+00  2.474e+00 
o endo_TS1: iso @ 13                                   673.8  1.612e+01  1.040e+00  2.781e+00 
                                                    -------------------------------------------------------------------------- 
  KIE @ 250.15 K                                    1.134624   3.741504   1.041031   0.889677   3.931826   1.308643   5.145356 
                                                    --------------------------------------------------------------------------
  KIE = 5.145356/1.080845 =4.760493872849484