#
#Opt TS
#
! optts freq wb97x-d3bj def2-tzvp(-f) def2/J tightscf tightopt
%pal nprocs 8 end
%maxcore 8000
%geom inhess read
inhessname "inhessts6.hess" end

* xyz 1 1
  C           0.14171489268221     -3.79239300469420     -0.02442763103527
  C           1.39169220133891     -3.21132692470824     -0.32913836323184
  C           1.52374363645721     -1.83868300184838     -0.37681360083459
  C           0.41745583592072     -0.99597676774009     -0.12947080021961
  C          -0.81987114504506     -1.58215689666075      0.18589791740038
  C          -0.96609315720432     -2.96188596302364      0.23947101585182
  H           2.23743062491249     -3.87527025796882     -0.51863391971490
  H           2.49956031423491     -1.40284182234021     -0.61233432731951
  H          -1.68891388824215     -0.96205670056830      0.42332565298566
  H          -1.93542487028618     -3.38642473988405      0.50115853605455
  C           0.61550520145118      0.45383382666166     -0.20136818906689
  H           1.64685073680843      0.81334839228537     -0.09684404997343
  H           0.28145075519763      0.91466166781023     -1.33108697907479
  H          -1.42093342356138      1.08337107661798     -0.39139787508515
  C          -0.22410491514273      2.87678993023717     -0.06729313994141
  C          -1.30006452832860      3.71390035748734     -0.42424760821591
  C           0.96104282735073      3.44301815387517      0.44674088392880
  C          -1.18722367044880      5.09355889239389     -0.28903732214110
  H          -2.22512812126835      3.27681696654723     -0.81212019854882
  C           1.06712634264316      4.82126064506015      0.57956697613913
  H           1.79178585309102      2.80920583592692      0.76713257146618
  C          -0.00365830836801      5.64455192356426      0.20886616856741
  H          -2.02138087172708      5.74134909463100     -0.56834187367389
  H           1.98139286282713      5.26144969862894      0.98458446378328
  H           0.08484514927789      6.72877019295109      0.31982269834535
  C          -0.39693458748764      1.44084619290512     -0.22387101360728
  O           0.10683936377433     -5.12179448469961      0.00250701335356
  C          -1.10644028524844     -5.79575827758647      0.30699739237808
  H          -0.87893907096358     -6.86732906834058      0.26197986501538
  H          -1.45722124354514     -5.53942183465727      1.32016882411942
  H          -1.88786885110045     -5.55679952286291     -0.43297537770462
*

