%chk=000015812.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000015812

0 1
 O  -0.3507000       2.203700       1.161000    
 N   -1.995400     -0.8219000     -0.2411000    
 N   -2.245600      -1.407000       1.043600    
 C   -1.753300      0.6127000     -4.2300001E-02
 C  -0.5666000      0.8092000      0.9278000    
 C   0.7401000      0.2451000      0.4124000    
 C   -1.502100       1.243500      -1.413200    
 C   -3.157100      -1.033800      -1.099200    
 C    1.071800      -1.066300      0.7051000    
 C    1.574600       1.053300     -0.3399000    
 C    2.276100      -1.585900      0.2303000    
 C    2.778700      0.5336000     -0.8148000    
 C    3.129500     -0.7861000     -0.5298000    
 H   -2.631100       1.112600      0.3936000    
 H  -0.7723000      0.3899000       1.920000    
 H   -1.115600       2.263600      -1.311100    
 H  -0.7863000      0.6748000      -2.017500    
 H   -2.427900       1.338000      -1.991600    
 H   -2.943400     -0.7827000      -2.143300    
 H   -4.039600     -0.4711000     -0.7708000    
 H   -3.432000      -2.096400      -1.116000    
 H   0.4345000      -1.698400       1.314000    
 H    1.326000       2.080900     -0.5866000    
 H   -1.178600       2.572700       1.513200    
 H   -3.131400      -1.071200       1.420800    
 H   -2.335800      -2.417400      0.9464000    
 H    2.551900      -2.611700      0.4567000    
 H    3.442600       1.155400      -1.408200    
 H    4.067400      -1.190500     -0.8990000    


%chk=000015812-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000015812

0 1
O -0.400740 2.276319 1.108243
N -2.238588 -0.825713 0.073549
N -2.773123 -0.992833 1.409140
C -1.761645 0.586039 -0.081078
C -0.536944 0.825004 0.870414
C 0.795535 0.321218 0.330075
C -1.433589 0.958433 -1.535950
C -3.187292 -1.295237 -0.965653
C 0.998056 -1.069953 0.132689
C 1.849031 1.218069 0.025453
C 2.229414 -1.552210 -0.364025
C 3.082214 0.733628 -0.468484
C 3.278670 -0.652320 -0.666300
H -2.570646 1.276202 0.281501
H -0.783527 0.304756 1.817780
H -0.930446 1.941589 -1.537236
H -0.744855 0.225623 -1.990734
H -2.339666 1.039537 -2.161400
H -2.724526 -1.241415 -1.963749
H -4.140719 -0.708350 -0.985798
H -3.436883 -2.351634 -0.762827
H 0.177758 -1.761589 0.351104
H 1.692703 2.286753 0.194494
H -1.196670 2.582627 1.610410
H -3.768869 -0.714637 1.496090
H -2.604779 -1.943725 1.755069
H 2.371699 -2.629423 -0.511063
H 3.890423 1.438982 -0.695366
H 4.236404 -1.027138 -1.045849


