%chk=000007739.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000007739

0 1
 O   -3.166000      -1.157700     -0.6624000    
 N    1.808000     -1.8500000E-02 -0.1624000    
 C   0.6145000      0.6897000      0.2849000    
 C  -0.6409000     -8.9199997E-02 -0.1022000    
 C    1.879200      -1.346400      0.4498000    
 C    3.012700      0.7511000      0.1530000    
 C   -1.905000      0.6464000      0.3388000    
 C    3.083300      -2.121200     -5.8200002E-02
 C    2.960100       2.134400     -0.4732000    
 C   -3.174600     -8.1299998E-02 -6.7400001E-02
 C   -4.471300      0.5926000      0.2994000    
 H   0.6326000      0.8604000       1.369300    
 H   0.5247000       1.666500     -0.2013000    
 H  -0.6866000      -1.070000      0.3801000    
 H  -0.6651000     -0.2563000      -1.186700    
 H    1.902400      -1.295100       1.545500    
 H    1.025900      -1.965800      0.1636000    
 H    3.168900      0.8430000       1.235200    
 H    3.899700      0.2687000     -0.2703000    
 H   -1.913600      0.7582000       1.428700    
 H   -1.933300       1.643400     -0.1150000    
 H    3.158500      -2.085700      -1.150500    
 H    4.023100      -1.765700      0.3753000    
 H    2.989200      -3.175300      0.2275000    
 H    2.662700       2.094700      -1.526900    
 H    2.289900       2.812800      6.3600004E-02
 H    3.956100       2.590400     -0.4347000    
 H   -4.528600       1.567900     -0.1902000    
 H   -4.528600      0.7106000       1.384300    
 H   -5.313200     -2.0500001E-02 -3.4000002E-02


%chk=000007739-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000007739

0 1
O -3.217867 -1.221660 -0.644892
N 1.852902 -0.006298 0.118157
C 0.575245 0.544587 0.637475
C -0.660791 -0.020919 -0.093255
C 2.128972 -1.380506 0.620413
C 3.002165 0.917716 0.316928
C -1.972344 0.578516 0.449215
C 3.042318 -2.191587 -0.318843
C 3.003780 2.096300 -0.676005
C -3.241079 -0.091236 -0.089825
C -4.543231 0.685064 0.085307
H 0.468811 0.368249 1.741192
H 0.594359 1.642551 0.500663
H -0.708401 -1.120887 0.000887
H -0.562214 0.190298 -1.173762
H 2.569428 -1.354950 1.650578
H 1.162601 -1.909307 0.708107
H 3.037307 1.306313 1.367675
H 3.930592 0.336897 0.169378
H -2.006786 0.478228 1.557819
H -2.032246 1.669116 0.254843
H 2.581063 -2.269163 -1.318503
H 4.035886 -1.722295 -0.438091
H 3.199939 -3.211079 0.080568
H 3.029843 1.716652 -1.712145
H 2.103183 2.727937 -0.568913
H 3.886828 2.741656 -0.510023
H -4.591231 1.493426 -0.670929
H -4.594908 1.168013 1.078287
H -5.409422 0.020470 -0.058706


