%chk=000088183.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000088183

0 1
 O    3.107000     -0.4548000     -0.1851000    
 O    2.328100       1.597600      0.5248000    
 N   -1.636000      0.2511000     -0.2878000    
 C   -1.874800     -0.9623000      0.5063000    
 C   -2.721100       1.225800     -0.1079000    
 C   -3.195600      -1.626700      0.1149000    
 C   -4.069500      0.6329000     -0.5198000    
 C   -4.363900     -0.6554000      0.2402000    
 C  -0.3482000      0.8482000      6.5099999E-02
 C   0.7882000     -0.1231000     -0.2406000    
 C    2.139700      0.4709000      8.6900003E-02
 C    4.450800     -3.7200000E-02  7.6700002E-02
 C    5.395400      -1.167000     -0.2738000    
 H   -1.877600     -0.7364000       1.580700    
 H   -1.114200      -1.726800      0.3293000    
 H   -2.534200       2.109700     -0.7300000    
 H   -2.772100       1.565800      0.9349000    
 H   -3.373900      -2.501200      0.7510000    
 H   -3.132900      -1.990600     -0.9187000    
 H   -4.067200      0.4287000      -1.598000    
 H   -4.866600       1.361600     -0.3344000    
 H   -5.280400      -1.117400     -0.1427000    
 H   -4.536200     -0.4248000       1.298700    
 H  -0.3212000       1.143900       1.122500    
 H  -0.1920000       1.761600     -0.5234000    
 H   0.7814000     -0.3958000      -1.302100    
 H   0.7293000      -1.028200      0.3704000    
 H    4.684600      0.8432000     -0.5321000    
 H    4.554100      0.2161000       1.137700    
 H    6.433900     -0.8812000     -8.5199997E-02
 H    5.162200      -2.060800      0.3143000    
 H    5.290500      -1.443900      -1.328000    


%chk=000088183-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000088183

0 1
O 3.209167 -0.471950 -0.124363
O 2.374095 1.701796 -0.073031
N -1.654382 0.164939 -0.120139
C -2.049872 -1.086460 0.578586
C -2.700590 1.212275 0.025587
C -3.383249 -1.635861 0.030878
C -4.048886 0.735838 -0.549358
C -4.501527 -0.574184 0.135037
C -0.324251 0.666252 0.299369
C 0.822601 -0.227038 -0.214603
C 2.171775 0.465503 -0.121343
C 4.598302 0.085197 -0.106378
C 5.549839 -1.105606 -0.160734
H -2.150182 -0.909219 1.684144
H -1.253653 -1.840122 0.439721
H -2.358243 2.118096 -0.508674
H -2.843060 1.493966 1.103664
H -3.658726 -2.551342 0.589438
H -3.241167 -1.919287 -1.029973
H -3.930842 0.563838 -1.636735
H -4.807593 1.530754 -0.414579
H -5.437217 -0.949658 -0.320853
H -4.719954 -0.373453 1.204781
H -0.246132 0.773470 1.412037
H -0.184108 1.676196 -0.125983
H 0.627554 -0.458397 -1.281050
H 0.887369 -1.194251 0.312214
H 4.713244 0.761474 -0.972937
H 4.719445 0.684675 0.814037
H 6.596382 -0.749876 -0.151596
H 5.400692 -1.769593 0.707802
H 5.390768 -1.694472 -1.080164


