%chk=000005365.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000005365

0 1
 O   -2.399700       1.496000     -7.7999998E-03
 O    1.269800       1.847000      8.9699998E-02
 O   -1.954600     -8.7300003E-02  -1.567900    
 O    2.817500      0.4201000      0.9326000    
 N    2.198600      -1.370500      -1.054200    
 C   9.8999999E-02  -1.204800      0.1929000    
 C   -1.110000     -0.3928000      0.6994000    
 C    1.154200     -0.4371000     -0.6193000    
 C   -2.077500      -1.222500       1.542900    
 C   -1.844800      0.3269000     -0.4213000    
 C    1.847500      0.6251000      0.2128000    
 H   0.5820000      -1.666400       1.066000    
 H  -0.2779000      -2.033900     -0.4224000    
 H  -0.7071000      0.3908000       1.355400    
 H   0.7233000      2.4300000E-02  -1.512800    
 H   -1.564200      -1.669800       2.400100    
 H   -2.520200      -2.028700      0.9482000    
 H   -2.897900     -0.6032000       1.921000    
 H    2.648700      -1.796600     -0.2449000    
 H    2.924900     -0.8671000      -1.561900    
 H   -2.879400       1.949500     -0.7334000    
 H    1.722500       2.522800      0.6379000    


%chk=000005365-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000005365

0 1
O -2.584917 1.419505 0.095403
O 1.230395 1.883482 0.001257
O -1.736184 0.118221 -1.624737
O 2.725879 0.504638 1.124392
N 2.241286 -1.459016 -1.016702
C 0.101287 -1.214776 0.189353
C -1.048292 -0.333021 0.725582
C 1.225036 -0.483358 -0.600417
C -2.069495 -1.189329 1.530569
C -1.779259 0.384493 -0.402889
C 1.823182 0.638797 0.267281
H 0.561242 -1.744035 1.047358
H -0.300245 -1.979306 -0.498864
H -0.660583 0.451130 1.403005
H 0.775048 -0.027561 -1.497358
H -1.556670 -1.680324 2.376701
H -2.510096 -1.977175 0.893155
H -2.883891 -0.562460 1.930602
H 2.794654 -1.824240 -0.233020
H 2.836245 -1.140913 -1.787787
H -3.058762 1.857126 -0.663090
H 1.628839 2.579922 0.593208


