%chk=000057567.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000057567

0 1
 O  -7.4699998E-02   1.292100      0.2868000    
 O   0.5228000     -0.5993000     -0.8964000    
 O   -2.050900     -2.5300000E-02  0.2502000    
 O   -4.050900      0.4979000     -0.7850000    
 N    4.456200     -0.2604000      0.5380000    
 C    5.423600      0.1408000     -0.4738000    
 C    5.405900      -1.258800      6.7699999E-02
 C    3.145400     -0.4746000     -6.1500002E-02
 C    2.152100      0.5550000      0.4583000    
 C   0.7893000      0.3293000     -0.1448000    
 C   -1.431300       1.197600     -0.1950000    
 C   -2.194200       2.380100      0.3848000    
 C   -3.343500     -0.2372000     -0.1148000    
 C   -3.756300      -1.539300      0.4484000    
 C   -4.993200      -1.997900      0.2371000    
 H    5.103500      0.3051000      -1.494200    
 H    6.208200      0.8036000     -0.1314000    
 H    6.178200      -1.538900      0.7717000    
 H    5.050800      -2.054600     -0.5743000    
 H    3.144800     -0.4630000      -1.160700    
 H    2.786200      -1.472800      0.2265000    
 H    2.061700      0.4829000       1.548100    
 H    2.482600       1.565100      0.1898000    
 H   -1.421400       1.240400      -1.291300    
 H   -1.624900       3.305900      0.2463000    
 H   -2.343100       2.251400       1.463200    
 H   -3.176600       2.530300     -6.7000002E-02
 H   -3.044800      -2.113100       1.031700    
 H   -5.295500      -2.954200      0.6509000    
 H   -5.727900      -1.448700     -0.3414000    


%chk=000057567-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000057567

0 1
O -0.116838 1.301546 0.297357
O 0.208845 -0.572869 -1.068740
O -2.234033 0.344189 0.620676
O -3.641514 -0.036247 -1.215886
N 4.274856 -0.756907 0.475642
C 5.316800 0.267119 0.087377
C 5.497631 -1.197128 -0.286995
C 3.007187 -0.716525 -0.302641
C 2.024803 0.225165 0.413117
C 0.651297 0.228190 -0.220997
C -1.507382 1.384753 -0.154344
C -2.031161 2.766054 0.193236
C -3.259588 -0.343221 -0.062006
C -3.792652 -1.425363 0.802770
C -4.797959 -2.232213 0.375111
H 5.078181 0.965225 -0.728194
H 5.884451 0.698578 0.917375
H 6.197758 -1.825661 0.271473
H 5.380985 -1.460714 -1.347721
H 3.151059 -0.386841 -1.360123
H 2.589090 -1.738093 -0.330699
H 1.918181 -0.097377 1.467314
H 2.409805 1.260565 0.452841
H -1.584673 1.125551 -1.225390
H -1.439091 3.537195 -0.328289
H -1.964976 2.938004 1.280002
H -3.083451 2.852623 -0.125337
H -3.328054 -1.535391 1.787753
H -5.192539 -3.036798 1.004016
H -5.234917 -2.094010 -0.620799


