KINISOT.py v 2.0.1: 2023-09-28 11:12 
  Found vibrational scaling factor 0.985 for RB3LYP/def2TZVPP level of theory 
  REF: I. M. Alecu, unpublished (2011). 

                                                     Temp = 250.15K / Vib. scale factor = 0.985 
                                                     V-ratio        ZPE        EXC       TRPF        KIE    1D-tunn   corr-KIE 
o endo_react                                        -------------------------------------------------------------------------- 
o endo_TS1                                             559.8 
o endo_react: iso @ 14                                        6.910e+01  1.086e+00  2.682e+00 
o endo_TS1: iso @ 14                                   536.7  5.672e+01  1.058e+00  2.798e+00 
                                                    -------------------------------------------------------------------------- 
  KIE @ 250.15 K                                    1.042995   1.218347   1.027074   0.958269   1.250668   1.043402   1.304949 
                                                    --------------------------------------------------------------------------
 KIE = 3.555073  / 1.304949 = 2.724300336641509