KINISOT.py v 2.0.1: 2023-09-17 14:17 
  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  REF: I. M. Alecu, unpublished (2011).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                                             351.1 
o endo-react: iso @ 13                                        6.445e+01  1.082e+00  2.677e+00 
o endo-TS1: iso @ 13                                   334.9  3.097e+01  1.052e+00  2.793e+00 
                                                    -------------------------------------------------------------------------- 
  KIE @ 250.15 K                                    1.048233   2.081008   1.028738   0.958549   2.151050   1.016503   2.186549 
                                                    --------------------------------------------------------------------------
 KIE 2.186549 /1.243935 = 1.757767889801316