KINISOT.py v 2.0.1: 2023-10-12 09:21 
                                                      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                                             355.0 
o endo-react: iso @ 14                                        5.554e+01  1.093e+00  2.609e+00 
o endo-TS1: iso @ 14                                   332.5  5.428e+01  1.043e+00  2.797e+00 
                                                    -------------------------------------------------------------------------- 
  KIE @ 250.15 K                                    1.067648   1.023270   1.048215   0.932898   1.068324   1.023115   1.093018 
                                                    --------------------------------------------------------------------------
 KIE = 1.975312 /1.093018 = 1.80720903040938