%chk=000037685.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000037685

0 1
 O    1.021600       1.592100      0.2777000    
 N   0.8914000     -0.7254000      0.6958000    
 N    4.088000      0.8426000      0.1551000    
 C  -0.7847000      0.2255000     -0.7102000    
 C  -0.9800000      -1.264100     -0.4990000    
 C   0.4906000      0.4985000      0.1398000    
 C   2.8300000E-02  -1.765100      0.3266000    
 C   -1.928000       1.026600     -0.1733000    
 C    2.038400     -0.9153000       1.552300    
 C  -0.5184000      0.5713000      -2.172400    
 C   -1.964600      -2.100800      -1.001100    
 C    3.265600      -1.407500      0.7875000    
 C   8.5299999E-02  -3.103200      0.6772000    
 C   -1.900800       1.476600       1.144600    
 C   -3.014800       1.319900     -0.9936000    
 C    3.722100     -0.4786000     -0.3411000    
 C   -1.921900      -3.453700     -0.6567000    
 C  -0.9053000      -3.950600      0.1758000    
 C   -2.966800       2.223900       1.645300    
 C   -4.080800       2.067300     -0.4927000    
 C   -4.056800       2.519300      0.8267000    
 C    4.508500       1.709500     -0.9368000    
 C    4.883200       3.091100     -0.4277000    
 H    1.782500      -1.613200       2.357300    
 H    2.265300      4.2100001E-02   2.035900    
 H   -1.277100      0.1798000      -2.858900    
 H  -0.4348000       1.653900      -2.328200    
 H   0.4356000      0.1378000      -2.501000    
 H    3.059100      -2.394300      0.3557000    
 H    4.089200      -1.547800       1.498900    
 H   -2.750800      -1.726700      -1.647600    
 H   0.8639000      -3.502700       1.316600    
 H   -1.094000       1.247900       1.833500    
 H   -3.085800      0.9706000      -2.018100    
 H    2.933500     -0.4018000      -1.098300    
 H    4.588500     -0.9413000     -0.8301000    
 H   -2.681900      -4.131000      -1.037100    
 H  -0.8903000      -5.006900      0.4307000    
 H   -2.952400       2.569500       2.674900    
 H   -4.932400       2.292900      -1.127900    
 H    4.837200      0.7590000      0.8415000    
 H   -4.888100       3.098600       1.217500    
 H    5.372400       1.278800      -1.456800    
 H    3.697200       1.816800      -1.666400    
 H    4.035700       3.569800      7.4400000E-02
 H    5.716900       3.039600      0.2807000    
 H    5.187600       3.731900      -1.261400    


%chk=000037685-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000037685

0 1
O 0.948888 1.537026 -0.421176
N 0.896894 -0.629843 0.534231
N 4.520408 0.825197 -0.031758
C -1.004446 -0.024892 -0.813586
C -1.087347 -1.471159 -0.337136
C 0.380413 0.428353 -0.230747
C 0.051029 -1.768786 0.459678
C -2.106837 0.905972 -0.249488
C 2.162260 -0.569698 1.287679
C -0.947565 0.063039 -2.367934
C -2.041910 -2.468055 -0.586021
C 3.335696 -1.275665 0.566362
C 0.243064 -3.037329 1.040278
C -3.143775 0.430064 0.591482
C -2.075204 2.289967 -0.570729
C 3.900369 -0.400366 -0.576684
C -1.864692 -3.757374 -0.016704
C -0.737684 -4.030560 0.793179
C -4.137587 1.309297 1.080907
C -3.066211 3.166829 -0.081234
C -4.107668 2.680021 0.743028
C 4.520405 2.011198 -0.918566
C 5.157338 3.218558 -0.209064
H 1.987549 -1.006327 2.289012
H 2.429566 0.495944 1.405840
H -1.920918 -0.228500 -2.799712
H -0.714404 1.092658 -2.686495
H -0.168811 -0.609861 -2.769022
H 3.014236 -2.259543 0.171647
H 4.137583 -1.468797 1.306769
H -2.917025 -2.256499 -1.210824
H 1.119639 -3.260513 1.656559
H -3.176126 -0.626307 0.874322
H -1.252429 2.685168 -1.174875
H 3.069697 -0.089546 -1.237506
H 4.595308 -1.009021 -1.203611
H -2.604761 -4.542585 -0.203707
H -0.613633 -5.027057 1.231849
H -4.931772 0.920580 1.728731
H -3.021056 4.231487 -0.337263
H 5.451230 0.644015 0.368896
H -4.878229 3.360859 1.122015
H 5.052501 1.829656 -1.886598
H 3.465157 2.237230 -1.161128
H 4.611247 3.443549 0.723788
H 6.216736 3.022375 0.048998
H 5.129976 4.112440 -0.858083


