!  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   1.027231   0.850624  -0.089853
O   0.389227   1.877273  -0.160804
O   0.503574  -0.352946   0.005027
O   2.357137   0.901013  -0.107593
C   3.254813  -0.253176   0.027607
C   4.631437   0.396196  -0.043419
C   3.068261  -1.220794  -1.135448
C   3.055887  -0.923146   1.382419
H   4.763334   0.913239  -0.997168
H   5.407582  -0.367419   0.047534
H   4.757945   1.119650   0.765836
H   3.147346  -0.689740  -2.088040
H   2.103677  -1.724385  -1.089609
H   3.857254  -1.976695  -1.101127
H   3.138093  -0.184970   2.184976
H   3.836117  -1.674752   1.529279
H   2.085763  -1.414310   1.451116
H  -0.509669  -0.281570  -0.002061
N  -2.147796  -0.239492  -0.005992
C  -2.749664   0.950999   0.065510
C  -4.129398   1.087844   0.089139
C  -4.912522  -0.058087   0.033907
C  -4.288044  -1.296521  -0.043751
C  -2.902199  -1.340177  -0.059979
H  -2.084527   1.807380   0.100212
H  -4.576257   2.072239   0.149976
H  -5.994077   0.013335   0.050297
H  -4.859255  -2.215234  -0.090536
H  -2.373069  -2.285615  -0.118572
*

