!  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  -0.260924  -1.065135  -0.051282
O  -0.549449  -2.117877   0.464810
O  -0.976814  -0.192124  -0.660957
O  -2.613990  -0.523647  -0.845196
C  -3.329794   0.335839   0.013031
C  -4.794990  -0.007120  -0.285239
C  -3.060080   1.806672  -0.318846
C  -3.019149   0.050593   1.484604
H  -5.023058   0.177631  -1.338386
H  -5.459906   0.608390   0.328228
H  -4.994004  -1.059563  -0.065945
H  -3.267196   1.998226  -1.375797
H  -2.014745   2.055696  -0.122452
H  -3.691643   2.465668   0.285140
H  -3.190823  -1.005437   1.706252
H  -3.650853   0.656974   2.141474
H  -1.973514   0.280861   1.707672
H   1.182292  -0.489350  -0.093458
N   2.309894  -0.147184  -0.054747
C   3.267554  -1.064768  -0.205285
C   4.599959  -0.703192  -0.153872
C   4.919543   0.633174   0.058547
C   3.904078   1.570123   0.213075
C   2.592312   1.140769   0.150953
H   2.933707  -2.082936  -0.364425
H   5.368098  -1.455101  -0.275691
H   5.956737   0.942948   0.105012
H   4.121384   2.616634   0.379888
H   1.745242   1.807106   0.262356
*

