%chk=000098010.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000098010

0 1
 O   -1.829500     -0.1524000     -0.1846000    
 O  -0.9838000       1.827700      0.6462000    
 N   0.3355000      -2.636800      0.6060000    
 C    2.985500     -7.0699997E-02  0.1425000    
 C    1.615900      0.5882000      9.9600002E-02
 C   0.4456000     -7.1199998E-02  0.2693000    
 C    3.443500     -0.5578000      -1.225500    
 C    1.696500       2.088400     -9.8300003E-02
 C  -0.8475000      0.6715000      0.2754000    
 C   -3.141800      0.4175000     -0.2277000    
 C   -4.111500     -0.6171000     -0.7576000    
 C   0.3915000      -1.487400      0.4546000    
 H    3.724600      0.6283000      0.5535000    
 H    2.979600     -0.9191000      0.8376000    
 H    1.701700       2.601900      0.8682000    
 H   0.8847000       2.474000     -0.7217000    
 H    2.618000       2.360400     -0.6260000    
 H    3.512900      0.2706000      -1.938100    
 H    4.432500      -1.020600      -1.148900    
 H    2.753700      -1.302800      -1.635500    
 H   -3.440600      0.7226000      0.7813000    
 H   -3.138000       1.293200     -0.8864000    
 H   -5.127100     -0.2141000     -0.8037000    
 H   -3.815300     -0.9453000      -1.759400    
 H   -4.112500      -1.506800     -0.1191000    


%chk=000098010-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000098010

0 1
O -1.935165 -0.182441 -0.154047
O -0.987020 1.947091 -0.126646
N 0.289836 -2.685239 0.208965
C 2.941751 -0.239219 0.195452
C 1.665076 0.571296 0.075086
C 0.427073 -0.055753 0.043718
C 3.674211 -0.354139 -1.173712
C 1.837176 2.069911 -0.032898
C -0.857324 0.696014 -0.085788
C -3.290298 0.440596 -0.271261
C -4.286458 -0.706415 -0.398676
C 0.340057 -1.492026 0.135221
H 3.613885 0.266620 0.916150
H 2.737040 -1.252989 0.579766
H 1.420274 2.575760 0.858457
H 1.277178 2.493235 -0.883814
H 2.904779 2.331803 -0.120889
H 3.901277 0.640059 -1.598836
H 4.626968 -0.897149 -1.045831
H 3.056768 -0.908704 -1.901338
H -3.463313 1.057953 0.629029
H -3.290251 1.107664 -1.152263
H -5.311838 -0.302222 -0.481280
H -4.076185 -1.312168 -1.296167
H -4.241397 -1.367340 0.483303


