%chk=000029741.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000029741

0 1
 O   -2.478200       2.559000     -0.1731000    
 O   -1.035500      -1.672400      5.4699998E-02
 O   0.2691000      0.2490000       2.300300    
 O   -3.043700      -1.472700      -1.052600    
 N   -2.906500       1.304300     -0.5898000    
 C  -0.9592000       1.134500      0.4882000    
 C    1.500300      0.4728000      0.3458000    
 C   0.2686000      0.5954000       1.109100    
 C   -1.959700      0.4596000     -0.1716000    
 C    1.530500      0.8548000     -0.9954000    
 C    2.651700     -2.6400000E-02  0.9549000    
 C   -1.294200       2.434600      0.4794000    
 C   -2.091800     -0.9441000     -0.4407000    
 C    2.712000      0.7374000      -1.727700    
 C    3.833100     -0.1436000      0.2226000    
 C   -1.051400      -3.088900     -0.1521000    
 C    3.863100      0.2383000      -1.118700    
 C   0.1919000      -3.691500      0.4666000    
 H  -0.8602000       3.350400      0.8521000    
 H   0.6607000       1.246900      -1.513200    
 H    2.657000     -0.3323000       1.997700    
 H   -1.944900      -3.513800      0.3179000    
 H   -1.071200      -3.298000      -1.227200    
 H    2.735900       1.034200      -2.772200    
 H    4.729700     -0.5326000      0.6963000    
 H    4.782900      0.1467000      -1.688800    
 H   0.2117000      -4.776000      0.3287000    
 H    1.092800      -3.260800      1.7100001E-02
 H   0.2352000      -3.469400       1.538000    


%chk=000029741-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000029741

0 1
O -3.024776 2.383837 0.445540
O -0.912471 -1.548235 0.082262
O 0.659163 1.486931 2.410172
O -1.908584 -1.058317 -1.976831
N -3.075676 1.152865 -0.352047
C -0.996463 1.377221 0.700518
C 1.442506 0.585817 0.313727
C 0.390197 1.151550 1.215052
C -1.852355 0.595127 -0.171994
C 1.342933 0.640891 -1.102424
C 2.605013 0.026963 0.910052
C -1.784758 2.461083 1.057046
C -1.581224 -0.729923 -0.816803
C 2.385565 0.134401 -1.907735
C 3.639576 -0.487973 0.105141
C -0.519478 -2.904387 -0.427699
C 3.531747 -0.436863 -1.306949
C 0.233622 -3.592962 0.703928
H -1.603534 3.323576 1.693860
H 0.472179 1.104187 -1.579491
H 2.673357 0.012527 2.002896
H -1.441975 -3.437708 -0.718938
H 0.101967 -2.759054 -1.329757
H 2.306344 0.189413 -2.998611
H 4.530249 -0.923602 0.570632
H 4.339066 -0.832165 -1.933482
H 0.547165 -4.602074 0.380125
H 1.134824 -3.019890 0.980495
H -0.404479 -3.697836 1.597613


