KINISOT.py v 2.0.1: 2023-09-21 13:31 

                                                     Temp = 226.15K / Vib. scale factor = 0.97 
                                                     V-ratio        ZPE        EXC       TRPF        KIE    1D-tunn   corr-KIE 
o endo-react                                        -------------------------------------------------------------------------- 
o endo-TS                                              313.8 
o endo-react: iso @ 13                                        8.432e+01  1.081e+00  2.681e+00 
o endo-TS: iso @ 13                                    302.1  4.567e+01  1.039e+00  2.777e+00 
                                                    -------------------------------------------------------------------------- 
  KIE @ 226.15 K                                    1.038730   1.846445   1.039566   0.965480   1.925015   1.013093   1.950219 
                                                    --------------------------------------------------------------------------
 KIE = 1.950219 /  1.237982 = 1.575320965894496