#
#Opt
#
! opt freq wb97x-d3bj def2-tzvp(-f) def2/J tightscf tightopt
%pal nprocs 4 end
%maxcore 8000

* xyz 1 1
 C                 -0.19044800   -2.87037900   -0.09154900
 C                  1.07815800   -2.29907300    0.30375600
 C                  1.41562600   -1.01984800    0.03702500
 C                  0.51913000   -0.14024900   -0.66824700
 C                 -0.73892700   -0.69929400   -1.08643700
 C                 -1.06760900   -1.99023700   -0.82610400
 H                  2.39588900   -0.66961700    0.34429200
 H                 -1.45386200   -0.07838300   -1.61370500
 H                 -2.03555100   -2.35686400   -1.13899900
 C                  0.90323700    1.14905300   -0.92157300
 H                  1.88448900    1.45142500   -0.55548500
 H                  0.73541600    2.64299100   -2.39776200
 H                 -0.81279900    1.89253600   -2.00294200
 C                 -0.09595700    3.31691400   -0.52855300
 C                 -1.04881100    3.11625700    0.47385200
 C                  0.66132400    4.48936700   -0.53311400
 C                 -1.25476200    4.08607500    1.45067900
 H                 -1.63968600    2.20313800    0.48708100
 C                  0.45741200    5.45786200    0.44669800
 H                  1.40279600    4.65538600   -1.31007100
 C                 -0.49990700    5.25745400    1.43882800
 H                 -2.00427200    3.92905600    2.21929200
 H                  1.04128700    6.37213700    0.43038200
 H                 -0.65964100    6.01416400    2.19958000
 C                  0.13257800    2.23537100   -1.57828100
 N                 -0.54990900   -4.12039200    0.17829200
 C                  0.12734700   -4.99273500    1.15250100
 C                 -1.72923500   -4.71586900   -0.46088200
 H                 -0.62025800   -5.67727500    1.55281700
 H                  0.92174400   -5.56796200    0.67130400
 H                  0.53872700   -4.41598700    1.97550300
 H                 -1.63358800   -5.79906300   -0.40266500
 H                 -2.64828000   -4.41459500    0.05174300
 H                 -1.78153100   -4.44183000   -1.51488400
 F                  1.98302600   -3.08945700    0.90203400
*

