KINISOT.py v 2.0.1: 2023-07-24 08:25 
  Found vibrational scaling factor 0.985 for RB3LYP/def2TZVPP level of theory 
  REF: I. M. Alecu, unpublished (2011). 

                                                     Temp = 226.15K / Vib. scale factor = 0.985 
                                                     V-ratio        ZPE        EXC       TRPF        KIE    1D-tunn   corr-KIE 
o Endo_TS1_G16_PCM_dichloroethane_def2tzvpp_v_01_reactant   -------------------------------------------------------------------------- 
o Endo_TS1_G16_PCM_dichloroethane_def2tzvpp_v_01       406.8 
o Endo_TS1_G16_PCM_dichloroethane_def2tzvpp_v_01_reactant: iso @ 13             1.029e+02  1.076e+00  2.648e+00 
o Endo_TS1_G16_PCM_dichloroethane_def2tzvpp_v_01: iso @ 13      386.6  3.858e+01  1.038e+00  2.790e+00 
                                                    -------------------------------------------------------------------------- 
  KIE @ 226.15 K                                    1.052317   2.666871   1.036140   0.949053   2.759674   1.030930   2.845032 
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