%chk=000030685.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000030685

0 1
 O   -2.901400      5.0799999E-02 -0.8889000    
 N  -0.6255000      1.6899999E-02 -0.7104000    
 N   -2.033700      5.3199999E-02   1.222600    
 C   0.6682000     -2.7000001E-03 -0.1398000    
 C    1.327500       1.195400      0.1354000    
 C    1.285800      -1.220200      0.1470000    
 C   0.6917000       2.515000     -0.1607000    
 C   0.6047000      -2.519800     -0.1364000    
 C    2.604100       1.176100      0.6970000    
 C    2.562400      -1.239400      0.7087000    
 C   -1.820300      4.2500000E-02 -5.6800000E-02
 C    3.221500     -4.1200001E-02  0.9837000    
 C   -4.018000     -0.1524000     -3.7599999E-02
 C   -3.491000      0.1553000       1.341800    
 C    1.014200       3.008900      -1.567400    
 C   0.9098000      -3.038400      -1.538100    
 H  -0.3939000       2.481100     -1.8900000E-02
 H    1.043000       3.261000      0.5644000    
 H   0.9299000      -3.270400      0.5961000    
 H  -0.4790000      -2.446900      4.6999999E-03
 H  -0.6268000      6.8000001E-03  -1.725900    
 H    3.131200       2.101300      0.9147000    
 H    3.057300      -2.180100      0.9354000    
 H    4.216000     -5.6299999E-02   1.419800    
 H   -4.347600      -1.192500     -0.1309000    
 H   -4.841100      0.5086000     -0.3237000    
 H   -3.758600       1.171900       1.650700    
 H   -3.883800     -0.5421000       2.087700    
 H    2.094200       3.120700      -1.711300    
 H   0.5463000       3.983000      -1.741800    
 H   0.6436000       2.313500      -2.328000    
 H   0.5634000      -2.338100      -2.305500    
 H   0.4084000      -3.997400      -1.703000    
 H    1.985200      -3.188900      -1.680700    


%chk=000030685-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000030685

0 1
O -2.872741 0.345047 -0.867778
N -0.564970 0.279997 -0.618579
N -2.033120 -0.713972 1.056180
C 0.744047 0.160233 -0.029292
C 1.516069 1.356633 0.092586
C 1.268243 -1.104695 0.373799
C 0.970027 2.706638 -0.355800
C 0.518949 -2.414180 0.175883
C 2.819187 1.273774 0.637781
C 2.567529 -1.131036 0.941014
C -1.769780 -0.079150 -0.055953
C 3.344450 0.038880 1.071632
C -4.089966 -0.120162 -0.133934
C -3.522095 -0.807124 1.160546
C 1.170402 2.977678 -1.873330
C 0.412231 -2.836171 -1.314625
H -0.105485 2.785716 -0.106202
H 1.483514 3.505963 0.209674
H 1.050552 -3.209370 0.732164
H -0.492340 -2.332699 0.614371
H -0.657419 0.878585 -1.440929
H 3.412557 2.190599 0.740163
H 2.974910 -2.095427 1.267579
H 4.348052 -0.011857 1.508223
H -4.632399 -0.814637 -0.797000
H -4.711172 0.766444 0.074638
H -3.861444 -0.296584 2.080050
H -3.827822 -1.866837 1.229294
H 2.243340 2.950814 -2.134687
H 0.769613 3.969120 -2.152620
H 0.665208 2.222087 -2.505707
H -0.139625 -2.082539 -1.903224
H -0.124448 -3.798764 -1.405119
H 1.413646 -2.957802 -1.766897


