#
#Single point
#
! b3lyp d3bj def2-tzvppd def2/J verytightscf defgrid3
%pal nprocs 6 end
%maxcore 8000
%cpcm epsilon 3.90
refrac 1.491 # Average from doi.org/10.1016/j.optmat.2006.07.010
rsolv 1.3 end

* xyz 0 2
  C          -0.02264859957071     -0.30594354398424     -0.00072632219800
  C          -0.01381171584739     -1.80751465467272     -0.00307870285177
  H          -0.50856487729365     -2.19677583661943     -0.90401003580104
  H           1.03033508748797     -2.17203491504827     -0.00402606760864
  H          -0.50795273812207     -2.19958764818127      0.89696495174368
  C          -0.00192443250600      0.41822784559443      1.20835321026027
  N           0.01294082570872      0.99244479101614      2.22526249701551
  C          -0.00171406784194      0.42211523539249     -1.20748047284482
  N           0.01334250798507      0.99967424650287     -2.22249180771518
*