%chk=000081274.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000081274

0 1
 O    1.879700      -1.298800      0.7231000    
 N    2.813000      0.6070000     -0.2184000    
 C   0.7475000     -0.2391000      -1.136700    
 C  -0.6086000     -6.0400002E-02 -0.5417000    
 C   -1.402800      -1.174200     -0.2692000    
 C   -1.082700       1.220400     -0.2582000    
 C    1.856500     -0.3921000     -0.1052000    
 C   -2.671000      -1.007200      0.2871000    
 C   -2.350900       1.387400      0.2982000    
 C   -3.145100      0.2735000      0.5709000    
 C    3.964300      0.6835000      0.6500000    
 H   0.7694000      -1.138200      -1.766500    
 H   0.9593000      0.5907000      -1.822400    
 H   -1.044700      -2.177600     -0.4839000    
 H  -0.4726000       2.095900     -0.4643000    
 H   -3.289200      -1.874500      0.4999000    
 H   -2.719800       2.384600      0.5196000    
 H   -4.132400      0.4036000       1.004400    
 H    2.696600       1.343400     -0.9077000    
 H    4.794100       1.117200      8.7300003E-02
 H    4.239100     -0.3084000       1.017300    
 H    3.714800       1.331400       1.494000    


%chk=000081274-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000081274

0 1
O 2.166614 -1.668973 -0.259979
N 2.651320 0.598856 -0.019471
C 0.754236 -0.048805 -1.461185
C -0.561956 0.079715 -0.693839
C -1.066089 -1.016802 0.053680
C -1.299803 1.289813 -0.716742
C 1.919141 -0.456039 -0.540116
C -2.282189 -0.900520 0.761643
C -2.519272 1.406227 -0.009510
C -3.014352 0.310382 0.732881
C 3.754158 0.398672 0.927612
H 0.673644 -0.845404 -2.222325
H 0.978871 0.897316 -1.987723
H -0.493262 -1.950989 0.083403
H -0.925843 2.142551 -1.298110
H -2.659743 -1.754529 1.335506
H -3.080119 2.347404 -0.040564
H -3.959239 0.397480 1.280934
H 2.373274 1.551334 -0.258958
H 4.698011 0.824621 0.540621
H 3.877931 -0.688255 1.059682
H 3.529168 0.854046 1.910162


