#
#Single Point
#
! wb97x-d3bj def2-tzvppd def2/J tightscf defgrid3
%pal nprocs 4 end
%maxcore 8000

* xyz 1 1
  C          -0.31101954570599     -2.48908612430696      0.30993007852250
  C           0.91461346722365     -2.38153957373563     -0.38570648800856
  C           1.64499081812604     -1.23096789317870     -0.32214769624991
  C           1.18929865539372     -0.11529770175971      0.43517309607163
  C          -0.04923306650638     -0.23027916958940      1.12421277098418
  C          -0.76996298451352     -1.38734683880298      1.06604738626833
  H           1.28080344687741     -3.21514052107508     -0.97130658893739
  H           2.58956069537148     -1.15543317156172     -0.85179865163998
  H          -0.42496751932652      0.62184334592004      1.67914715033393
  H          -1.71274512232326     -1.46747725902312      1.59366118066633
  C           2.23680967306812      0.94423922302251      0.91670141438536
  H           1.98997233923981      1.37143755500840      1.87945539750554
  H           3.26024976275288      0.60828229202082      0.81257057415374
  H           1.98494007660098      1.19145390730120     -1.21018540236258
  C           0.43059944711235      2.38240305072888     -0.25983039295061
  C          -0.39794844511268      2.46051533027486     -1.37973417231934
  C           0.23307734590999      3.25930305992488      0.80503892980707
  C          -1.42366568073106      3.39032353167891     -1.42608111258154
  H          -0.23837921439790      1.78674600335808     -2.21573243943333
  C          -0.79294778012183      4.19321506621942      0.75520875951727
  H           0.89116916339439      3.23991232575290      1.66632696854125
  C          -1.62437441588072      4.25555418171453     -0.35554753637793
  H          -2.06411132441311      3.44621027402845     -2.29840643573799
  H          -0.93543798449062      4.88050472651388      1.58084569754639
  H          -2.42302626896985      4.98728170619042     -0.39308098501169
  C           1.51538001810215      1.37551899387733     -0.25104031573511
  C          -1.12164207148625     -3.70228344717728      0.26326991862611
  C          -1.16192961721215     -4.54330484492493     -1.00782473887530
  C          -0.44494467887608     -5.06583078039569      0.17526728468962
  H          -2.03796731367433     -3.65938615617830      0.83763743506616
  H          -0.58690205375121     -4.18467912275367     -1.85225342839490
  H          -2.12682176925145     -4.96372698223154     -1.25927518865825
  H          -0.90538780087361     -5.85355583116480      0.75701360291771
  H           0.63767758844556     -5.07762183567605      0.16888536767129
*

