%chk=000056009.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000056009

0 1
 O    5.380600      0.5135000      0.1375000    
 O    4.129900       2.410800      9.0300001E-02
 N   -3.136400      0.2275000      3.2200001E-02
 N   -4.807800       1.693000     -0.1288000    
 C  -0.3139000      -2.377000     -0.2520000    
 C   -1.599700      -1.776700      0.3326000    
 C   0.8649000      -1.458400     -0.1136000    
 C   -1.804500     -0.2926000      3.6899999E-02
 C   0.6576000     -7.1599998E-02 -0.1125000    
 C  -0.7084000      0.4681000     -0.1849000    
 C    2.168300      -1.968700     -6.7000002E-02
 C    1.759900      0.7909000     -5.5500001E-02
 C    3.055200      0.2750000      4.4000000E-03
 C    3.259300      -1.103000     -1.4000000E-03
 C   -4.290400     -0.4813000      0.2482000    
 C   -3.504700       1.530600     -0.1894000    
 C   -5.303500      0.4427000      0.1443000    
 C    4.193600       1.177200      7.8699999E-02
 H  -0.4591000      -2.584400      -1.320100    
 H  -0.1151000      -3.335200      0.2429000    
 H   -1.603800      -1.906400       1.423100    
 H   -2.422700      -2.379500     -6.5600000E-02
 H  -0.7806000       1.531200     -0.3890000    
 H    2.339300      -3.041900     -8.6700000E-02
 H    1.600800       1.867400     -5.3800002E-02
 H    4.250400      -1.546000      3.8199998E-02
 H   -4.319700      -1.539600      0.4633000    
 H   -2.803200       2.328600     -0.3903000    
 H   -6.364400      0.2717000      0.2551000    
 H    6.141700       1.130400      0.1878000    


%chk=000056009-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000056009

0 1
O 5.478741 0.543150 0.242707
O 4.151082 2.447371 0.281761
N -3.126608 0.194618 -0.004283
N -4.886962 1.565347 -0.459864
C -0.358324 -2.353497 -0.427647
C -1.629793 -1.816599 0.270590
C 0.859896 -1.474150 -0.192420
C -1.797514 -0.323249 0.022511
C 0.660514 -0.059382 -0.093619
C -0.702451 0.486200 -0.121136
C 2.168630 -1.998748 -0.144481
C 1.785048 0.790053 0.031109
C 3.095061 0.252757 0.074096
C 3.288360 -1.149736 -0.009301
C -4.258551 -0.366286 0.624877
C -3.572612 1.363859 -0.646851
C -5.318943 0.491448 0.343481
C 4.234523 1.196961 0.206837
H -0.548112 -2.394706 -1.521471
H -0.160572 -3.390562 -0.101956
H -1.565304 -1.997933 1.363998
H -2.511316 -2.370280 -0.099529
H -0.816916 1.573228 -0.201436
H 2.316291 -3.082508 -0.219369
H 1.662363 1.876783 0.102823
H 4.303097 -1.554226 0.029376
H -4.202805 -1.271081 1.222672
H -2.921197 1.980154 -1.260385
H -6.355584 0.408273 0.660681
H 6.193558 1.229038 0.331125


