!  def2-TZVP AutoAux printbasis DLPNO-CCSD(T) TightSCF CPCM
%pal nprocs 8 
 end 
 %maxcore 2800
%cpcm 
 smd true 
 solvent "Acetone" 
 end 
* xyz 0 1 
C   1.027515   0.851081  -0.090657
O   0.390525   1.878097  -0.168649
O   0.502837  -0.351352   0.011381
O   2.357637   0.900773  -0.107552
C   3.255029  -0.253699   0.028127
C   4.631773   0.395238  -0.046849
C   3.065799  -1.223300  -1.133029
C   3.058363  -0.921148   1.384604
H   4.761838   0.910844  -1.001645
H   5.408047  -0.368371   0.043573
H   4.760378   1.119910   0.761011
H   3.142269  -0.693746  -2.086673
H   2.101666  -1.727480  -1.084079
H   3.855179  -1.978909  -1.099618
H   3.141943  -0.181490   2.185676
H   3.838794  -1.672602   1.531560
H   2.088386  -1.412238   1.456051
H  -0.510594  -0.279646   0.001171
N  -2.147843  -0.238462  -0.007261
C  -2.750872   0.951277   0.067960
C  -4.130678   1.086921   0.093313
C  -4.912935  -0.059409   0.035380
C  -4.287512  -1.297033  -0.046743
C  -2.901718  -1.339455  -0.063921
H  -2.087005   1.808626   0.104250
H  -4.578147   2.070895   0.157628
H  -5.994629   0.011024   0.053060
H  -4.857959  -2.216205  -0.095957
H  -2.371828  -2.284354  -0.125735
*

