!  def2-TZVP AutoAux printbasis DLPNO-CCSD(T) TightSCF CPCM
%pal nprocs 8 
 end 
 %maxcore 2800
%cpcm 
 smd true 
 solvent "NitroBenzene" 
 end 
* xyz 0 1 
C   0.782167   1.846403  -0.256294
O   1.554568   2.654583   0.157032
O   1.073351   0.631420  -0.771393
O   2.469283   0.359595  -0.795752
C   2.771653  -0.692523   0.162905
C   4.270366  -0.864985  -0.047671
C   2.010054  -1.962469  -0.196158
C   2.461465  -0.231089   1.581080
H   4.486580  -1.157611  -1.078034
H   4.639949  -1.646450   0.619889
H   4.803463   0.062421   0.175459
H   2.206763  -2.247469  -1.232702
H   0.934318  -1.827886  -0.064916
H   2.331273  -2.778724   0.455952
H   2.974014   0.707355   1.801597
H   2.796304  -0.989915   2.292708
H   1.387503  -0.089071   1.728595
H  -0.315864   1.931257  -0.301524
N  -2.368167   0.761207  -0.204156
C  -3.592467   1.075639   0.225029
C  -4.595089   0.135592   0.426888
C  -4.313760  -1.200134   0.171680
C  -3.042905  -1.538873  -0.274427
C  -2.108414  -0.525915  -0.445808
H  -3.780518   2.128263   0.415004
H  -5.571243   0.449283   0.776754
H  -5.070680  -1.962654   0.316888
H  -2.776053  -2.567173  -0.486409
H  -1.104682  -0.754746  -0.792605
*

