%chk=000004753.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000004753

0 1
 O    1.082000      -1.584400      0.4231000    
 O    3.617300     -0.5581000       1.099700    
 N    2.124900      0.2944000     -0.4818000    
 N    4.151500       1.322000     -0.1083000    
 C  -5.9900001E-02 -0.3088000      -1.290300    
 C   -1.359800     -4.4399999E-02 -0.5775000    
 C   -2.224400      -1.098900     -0.3201000    
 C   -1.674200       1.249900     -0.1885000    
 C    1.086100     -0.6300000     -0.3498000    
 C   -3.428400     -0.8540000      0.3400000    
 C   -2.878300       1.494800      0.4718000    
 C   -3.755300      0.4429000      0.7360000    
 C    3.318700      0.2745000      0.2455000    
 H   0.1774000      0.5421000      -1.940500    
 H  -0.1709000      -1.164000      -1.969700    
 H   -1.978500      -2.112900     -0.6227000    
 H  -0.9967000       2.075400     -0.3880000    
 H   -4.111200      -1.673000      0.5463000    
 H   -3.132800       2.504500      0.7807000    
 H   -4.692700      0.6336000       1.250400    
 H    2.020900       1.050300      -1.153000    
 H    3.887100       1.999200     -0.8157000    
 H    5.057000       1.444100      0.3325000    


%chk=000004753-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000004753

0 1
O 2.037656 -1.605811 -2.053975
O 3.985734 0.151744 -0.659999
N 1.608343 0.098603 -0.480874
N 2.919675 1.045551 1.211087
C -0.255532 -0.756121 -1.882197
C -1.202353 -0.147049 -0.862022
C -1.723381 -0.935634 0.199250
C -1.564675 1.225376 -0.926608
C 1.247890 -0.815101 -1.487665
C -2.579779 -0.368528 1.168871
C -2.421426 1.796446 0.043427
C -2.930298 1.000854 1.095634
C 2.933997 0.398156 -0.025128
H -0.292881 -0.192173 -2.834180
H -0.535045 -1.796172 -2.122893
H -1.459243 -1.998550 0.258710
H -1.185093 1.844778 -1.748895
H -2.978651 -0.993129 1.975954
H -2.696567 2.854597 -0.028034
H -3.598931 1.439278 1.844584
H 0.830775 0.618243 -0.059892
H 2.100192 1.088005 1.814511
H 3.819393 1.345836 1.580434


