#
#Opt TS
#
! optts freq wb97x-d3bj def2-tzvp(-f) def2/J tightscf tightopt
%pal nprocs 8 end
%maxcore 8000
%geom inhess read
inhessname "inhessts23.hess" end

* xyz 1 1
  C          -0.23157510672283     -3.20455919933954      0.08996792441799
  C           1.06985634326496     -2.63470689742240     -0.05860963703619
  C           1.28298977196404     -1.27871614367991     -0.12822029594632
  C           0.20833168481489     -0.36947634194922     -0.03752523822215
  C          -1.08114884424954     -0.89644926437648      0.14563831512769
  C          -1.29278586338827     -2.26245872476622      0.20917640855418
  H           2.31649558145563     -0.93785532920807     -0.23525871499978
  H          -1.94692350087573     -0.23841967605483      0.25918539213671
  H          -2.31078682074411     -2.62237151499461      0.34964273189900
  C           0.49429491888771      1.06237751510998     -0.12826891916294
  H           1.52686151007763      1.36807795454944      0.08193886584887
  H           0.31922874999633      1.48761484650789     -1.28783409931637
  H          -1.48075669073322      1.80038096214757     -0.50916451220183
  C          -0.22339961436127      3.52758897683855     -0.09061663368580
  C          -1.21982432079754      4.41694289637527     -0.54367281397362
  C           0.94558244423095      4.03913401563395      0.51291707657829
  C          -1.04372310966413      5.79012959383944     -0.41442425886779
  H          -2.13238683277906      4.02342082247575     -1.00140652791841
  C           1.11529618537618      5.41131561986214      0.63852391503152
  H           1.71181443027018      3.36665855751587      0.90651407209256
  C           0.12410873377227      6.28467454148572      0.17254880815739
  H          -1.81588314422662      6.47738046470801     -0.76782090516069
  H           2.01638964467592      5.80866789946292      1.11163653093499
  H           0.26222268561927      7.36423590545463      0.27848893708529
  C          -0.46039327550385      2.10443986198556     -0.24323641759005
  N          -0.46113199143229     -4.54056295526654      0.14553049352972
  C          -1.77421618363435     -5.02744187571674      0.54566002890161
  C           0.51638543680912     -5.54022770237384     -0.29029019876358
  H          -1.69868742954814     -6.09604639270644      0.78137496853230
  H          -2.12598110415404     -4.51141077682301      1.45202731485603
  H          -2.52871358919085     -4.90111199086675     -0.25149134446694
  H          -0.02760370448401     -6.45420530677688     -0.56104795331565
  H           1.06028962205300     -5.19722309406196     -1.17869254816069
  H           1.24510433359111     -5.78278584638322      0.49883007108767
  F           2.14596704963065     -3.43387140118602     -0.09341583598299
*

