%chk=000156311.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000156311

0 1
 O   -3.518600      -1.209000      4.5200001E-02
 O    3.010200     -0.3179000      -1.072500    
 N    1.398200       1.034200     -6.2300000E-02
 C   0.2044000      0.5265000     -3.7300002E-02
 C   -1.042300       1.354400     -1.2700000E-02
 C   4.0600002E-02 -0.9633000     -3.3000000E-02
 C   -2.246700      0.7729000      1.4100000E-02
 C   -1.182400      -1.506700     -5.7999999E-03
 C   -2.408000     -0.6904000      2.0400001E-02
 C  -0.9095000       2.849200     -1.8800000E-02
 C    1.281600      -1.804900     -5.9400000E-02
 C    2.455300      0.1568000     -8.3099999E-02
 C    2.917100     -0.2016000       1.305100    
 H   -3.158800       1.360800      3.2299999E-02
 H   -1.327600      -2.582500     -8.9999998E-04
 H   -1.881800       3.352900      8.9999998E-04
 H  -0.3828000       3.180500     -0.9198000    
 H  -0.3449000       3.184400      0.8575000    
 H   0.8656000      -2.834300     -0.1091000    
 H    1.798000      -2.003200      0.8733000    
 H    1.783400      -1.903900      -1.022700    
 H    2.098800     -0.3251000       2.020500    
 H    3.571800      -1.078800       1.295100    
 H    3.527400      0.6350000       1.666100    


%chk=000156311-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000156311

0 1
O -3.878752 -1.088120 -0.280387
O 3.111421 0.008625 -1.057902
N 1.278586 0.714528 0.179826
C 0.069413 0.226027 0.039274
C -1.056609 1.209807 0.033081
C -0.229938 -1.236792 -0.086570
C -2.347330 0.756860 -0.073183
C -1.539448 -1.635345 -0.192979
C -2.671316 -0.680819 -0.187805
C -0.716845 2.676448 0.141807
C 0.907442 -2.231858 -0.100022
C 2.593349 0.281150 0.069055
C 3.399723 0.359395 1.359233
H -3.197304 1.447916 -0.081890
H -1.804635 -2.694247 -0.291710
H -1.625783 3.297761 0.092995
H -0.029295 2.979483 -0.668316
H -0.187579 2.890149 1.088150
H 0.521533 -3.262724 -0.149000
H 1.535278 -2.147201 0.807658
H 1.574698 -2.063039 -0.964438
H 2.775871 0.181854 2.251695
H 4.222856 -0.371635 1.314208
H 3.843662 1.367778 1.450322


