!  def2-TZVP AutoAux printbasis DLPNO-CCSD(T) TightSCF CPCM
%pal nprocs 8 
 end 
 %maxcore 2800
%cpcm 
 smd true 
 solvent "o-Nitrotoluene" 
 end 
* xyz 0 1 
C   0.781570   1.846946  -0.256834
O   1.554489   2.654157   0.157207
O   1.072004   0.631524  -0.771741
O   2.467759   0.358929  -0.795873
C   2.769524  -0.692668   0.163232
C   4.268242  -0.865657  -0.046878
C   2.007592  -1.962533  -0.195518
C   2.459146  -0.230525   1.581149
H   4.484572  -1.158947  -1.077001
H   4.637676  -1.646677   0.621276
H   4.801329   0.061866   0.175623
H   2.204319  -2.247825  -1.231956
H   0.931907  -1.827381  -0.064532
H   2.328242  -2.778802   0.456850
H   2.971288   0.708270   1.800984
H   2.794160  -0.988735   2.293345
H   1.385146  -0.088721   1.728465
H  -0.316356   1.932628  -0.302882
N  -2.366139   0.761477  -0.205363
C  -3.589786   1.075579   0.225689
C  -4.592011   0.135363   0.428642
C  -4.310881  -1.200196   0.172523
C  -3.040677  -1.538597  -0.275615
C  -2.106588  -0.525450  -0.447967
H  -3.777589   2.128117   0.416310
H  -5.567667   0.448787   0.780086
H  -5.067480  -1.962855   0.318583
H  -2.774072  -2.566776  -0.488436
H  -1.103315  -0.753736  -0.796453
*

