%chk=000029962.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000029962

0 1
 O  -0.4675000     -0.8584000       1.861200    
 N   -2.673500     -0.5483000      3.4600001E-02
 N    3.296900       2.394900      0.2189000    
 C   -3.641600      0.2794000     -0.6686000    
 C   -5.117000      5.7999998E-02 -0.4686000    
 C   -4.464200       1.291200      8.3600000E-02
 C   -1.308700     -0.1540000     -0.3072000    
 C  -0.2671000      -1.002900      0.4487000    
 C    1.131700     -0.6102000      0.1133000    
 C    1.557800      0.7015000      0.3228000    
 C    2.014500      -1.554900     -0.4099000    
 C    2.866400       1.068200      9.2000002E-03
 C    3.323100      -1.188100     -0.7238000    
 C    3.749100      0.1235000     -0.5142000    
 H   -3.366000      0.5353000      -1.689400    
 H   -5.438200     -0.6993000      0.2363000    
 H   -5.766400      0.1734000      -1.327900    
 H   -4.671000       2.235200     -0.4058000    
 H   -4.347300       1.360200       1.158300    
 H   -2.806400      -1.529900     -0.2074000    
 H   -1.141400     -0.2518000      -1.387600    
 H   -1.192500      0.9046000     -4.4900000E-02
 H  -0.4290000      -2.062800      0.2150000    
 H   0.8816000       1.442200      0.7431000    
 H    1.698300      -2.580800     -0.5792000    
 H   -1.393300      -1.091500       2.046800    
 H    4.010400      -1.923700      -1.131400    
 H    4.771300      0.3969000     -0.7631000    
 H    2.658600       3.080000      0.6011000    
 H    4.246700       2.660300     -5.4000001E-03


%chk=000029962-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000029962

0 1
O -0.817885 -0.300070 1.709403
N -2.720717 -0.854447 -0.139936
N 3.423787 2.271253 0.916418
C -3.772115 -0.103394 -0.813034
C -5.017934 0.265783 -0.000208
C -3.995373 1.350722 -0.378679
C -1.338028 -0.654940 -0.647063
C -0.338562 -0.977962 0.506790
C 1.073797 -0.531975 0.157596
C 1.602070 0.649761 0.712463
C 1.841817 -1.291998 -0.763241
C 2.904275 1.101318 0.354423
C 3.131608 -0.843036 -1.124426
C 3.666986 0.342014 -0.579357
H -3.932167 -0.315956 -1.882859
H -5.039259 -0.056100 1.044751
H -5.986856 0.258839 -0.507171
H -4.267975 2.083374 -1.143119
H -3.349347 1.729876 0.418328
H -2.961523 -1.850452 -0.037557
H -1.095500 -1.259397 -1.547176
H -1.234037 0.411656 -0.914740
H -0.339506 -2.080796 0.673304
H 0.995403 1.197371 1.441648
H 1.444993 -2.225217 -1.180847
H -1.817799 -0.304665 1.591467
H 3.732225 -1.424870 -1.833598
H 4.672814 0.676015 -0.863730
H 2.889938 2.796265 1.602283
H 4.360168 2.589229 0.686369


