KINISOT.py v 2.0.1: 2023-07-24 08:26 
  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  REF: I. M. Alecu, unpublished (2011).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_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             6.595e+01  1.085e+00  2.648e+00 
o Endo_TS1_G16_PCM_dichloroethane_def2tzvpp_v_01: iso @ 13      386.6  2.717e+01  1.046e+00  2.790e+00 
                                                    -------------------------------------------------------------------------- 
  KIE @ 250.15 K                                    1.052317   2.427339   1.036638   0.949053   2.513013   1.024615   2.574871 
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