%chk=000014654.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000014654

0 1
 O   -2.554100      -2.251200     -0.4238000    
 O    5.612300       1.923900     -8.8000000E-03
 O    6.311000     -0.1210000      0.4014000    
 N    5.395300      0.6994000      0.1536000    
 C    1.439800     -0.7113000     -0.1414000    
 C   -3.564800     -0.1682000     -4.4399999E-02
 C    1.711300      0.6454000     -0.3173000    
 C    2.478900      -1.600800      0.1322000    
 C   7.3100001E-02  -1.198200     -0.2423000    
 C    4.061100      0.2234000      5.4000001E-02
 C    3.021800       1.112800     -0.2198000    
 C    3.789600      -1.133400      0.2299000    
 C   -2.388500      -1.053100     -0.2235000    
 C   -1.036800     -0.4361000     -0.1186000    
 C   -3.463800       1.160200     -0.4076000    
 C   -4.727100     -0.6983000      0.4799000    
 C   -4.570300       1.992600     -0.2395000    
 C   -5.833600      0.1342000      0.6478000    
 C   -5.755100       1.479800      0.2882000    
 H   0.9383000       1.371100     -0.5531000    
 H    2.286000      -2.661500      0.2739000    
 H  -2.8300000E-02  -2.263200     -0.4396000    
 H    3.196700       2.175500     -0.3675000    
 H    4.573400      -1.855300      0.4448000    
 H  -0.9651000      0.6136000      0.1341000    
 H   -2.576000       1.589800     -0.8593000    
 H   -4.802200      -1.742300      0.7690000    
 H   -4.512900       3.038200     -0.5281000    
 H   -6.756200     -0.2647000       1.059200    
 H   -6.617400       2.127400      0.4172000    


%chk=000014654-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000014654

0 1
O -2.475328 -2.215288 0.333079
O 5.895265 1.808151 -0.300050
O 6.528592 -0.376955 -0.112374
N 5.630297 0.549362 -0.175747
C 1.493569 -0.619784 0.038496
C -3.611490 -0.100418 0.106650
C 1.859229 0.754494 -0.094077
C 2.533986 -1.594440 0.098088
C 0.102373 -1.079377 0.118073
C 4.206913 0.143811 -0.101239
C 3.205736 1.141677 -0.164327
C 3.888416 -1.225398 0.029672
C -2.375105 -0.952701 0.179998
C -1.031122 -0.311987 0.076767
C -3.590939 1.302448 -0.129085
C -4.866685 -0.748484 0.277709
C -4.795616 2.035271 -0.191682
C -6.067572 -0.017195 0.217743
C -6.036069 1.379502 -0.017446
H 1.083631 1.525058 -0.141737
H 2.266663 -2.652082 0.200114
H -0.056911 -2.162596 0.224502
H 3.501929 2.188848 -0.266251
H 4.693282 -1.963331 0.074922
H -0.971771 0.775914 -0.024561
H -2.646462 1.836235 -0.272995
H -4.863679 -1.828846 0.455522
H -4.767991 3.114478 -0.376827
H -7.026840 -0.528273 0.352911
H -6.969900 1.950604 -0.065248


