KINISOT.py v 2.0.1: 2023-09-21 13:27 

                                                     Temp = 250.15K / 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 @ 14                                        5.879e+01  1.089e+00  2.671e+00 
o endo-TS: iso @ 14                                    303.7  5.024e+01  1.059e+00  2.761e+00 
                                                    -------------------------------------------------------------------------- 
  KIE @ 250.15 K                                    1.033290   1.170250   1.028514   0.967284   1.202998   1.009135   1.213987 
                                                    --------------------------------------------------------------------------
 KIE = 1.835972 / 1.213987 = 1.512348979025311