#
#Opt
#
! opt freq wb97x-d3bj def2-tzvp(-f) def2/J tightscf tightopt
%pal nprocs 4 end
%maxcore 8000
%geom inhess read
inhessname "inithessprod18.hess" end

* xyz 1 1
  C           0.08154159202168     -3.06193281371844      0.00157521500788
  C           1.10886634999571     -2.48646234744501      0.84099475922434
  C           1.48527030534845     -1.19145222755130      0.67704460426719
  C           0.89133641770937     -0.33569292862271     -0.32848915271205
  C          -0.13966775877459     -0.92433071392139     -1.15685349728680
  C          -0.52830912294245     -2.21680357082751     -1.00463289758210
  H           1.58751600813195     -3.08897921861019      1.61104133790743
  H           2.26360018956621     -0.77216911471343      1.32126918941514
  H          -0.62136461562753     -0.31717878520372     -1.92591712054438
  H          -1.30801750364371     -2.61696429364843     -1.65058458453614
  C           1.31689256749440      0.95957924386358     -0.45236462119077
  H           2.09857092296440      1.29410987964085      0.24193125274913
  H           1.67235838905063      2.44713173927850     -1.90907064227498
  H           0.11598457598505      1.61860462072816     -2.12653362224473
  C           0.14863970936014      3.09307264275170     -0.52619519989978
  C          -1.07019362223412      2.82347084561837      0.10915817403636
  C           0.75428881557053      4.34122520356105     -0.34853743100234
  C          -1.68380863958290      3.79542703015402      0.89896055671428
  H          -1.54983484228011      1.84709783588838     -0.01866439432345
  C           0.14114166731806      5.31346210824397      0.44366576174657
  H           1.70570239645856      4.56241900136941     -0.84206765547081
  C          -1.07748284866087      5.04230222689939      1.06779056342101
  H          -2.63964965714709      3.58017227982545      1.38397323020294
  H           0.61666122900850      6.28973164116527      0.56950892719646
  H          -1.55764254996068      5.80534341633683      1.68603745733065
  C           0.81214269496157      2.01311406092459     -1.37421640092596
  N          -0.29363534720296     -4.32836619808585      0.14812857851716
  C           0.32347583668056     -5.18242155065392      1.16944913439983
  C          -1.33407637840707     -4.91151690464330     -0.70685108390128
  H          -0.13041810680643     -6.17765432122927      1.12174810525430
  H           1.40477934508624     -5.28468265098929      0.99283615427432
  H           0.15535154645820     -4.77189157128051      2.17636869800296
  H          -1.48066772684396     -5.95880302237274     -0.42314816525597
  H          -2.28931711216477     -4.38041990127926     -0.57941480547805
  H          -1.03548488689098     -4.87751647145323     -1.76527359503837
*

