%chk=000114735.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000114735

0 1
 O   -1.511700       1.298100      0.8826000    
 O    1.058800       1.944300     -0.4957000    
 O   0.3269000      -2.564000      8.5000001E-02
 N   0.6143000     -0.3191000     -0.2347000    
 N    1.133600      -1.638500      0.2264000    
 N    2.678300      0.6272000      0.4027000    
 C   -1.781900      2.4599999E-02  0.2975000    
 C  -0.7335000     -0.2525000     -0.7828000    
 C   -3.204600      5.9500001E-02 -0.2458000    
 C    1.419700      0.8203000     -0.1351000    
 H   -1.710200     -0.7272000       1.091600    
 H  -0.7520000      0.5663000      -1.513300    
 H  -0.9630000      -1.169800      -1.336200    
 H   -3.474300     -0.8955000     -0.7066000    
 H   -3.319100      0.8543000     -0.9912000    
 H   -3.919000      0.2735000      0.5564000    
 H   -2.157500       1.437200       1.596100    
 H    3.026600     -0.2718000      0.7151000    
 H    3.316400       1.409700      0.5051000    


%chk=000114735-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000114735

0 1
O -1.451469 1.090648 1.125802
O 1.228206 1.848179 -0.996747
O 0.263919 -2.410014 0.460053
N 0.610811 -0.291977 -0.219078
N 1.092247 -1.431502 0.413636
N 2.702040 0.651466 0.376046
C -1.835490 -0.085780 0.322323
C -0.753555 -0.195104 -0.772262
C -3.225727 0.083884 -0.313605
C 1.531037 0.838065 -0.314327
H -1.816739 -0.998859 0.951288
H -0.765034 0.709237 -1.401943
H -0.947021 -1.094003 -1.384182
H -3.475460 -0.777146 -0.961061
H -3.262485 1.006621 -0.920014
H -4.007968 0.150828 0.465446
H -2.104193 1.210191 1.860620
H 2.865486 -0.218729 0.883368
H 3.399196 1.390596 0.341736


