%chk=000029939.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000029939

0 1
 O   0.2225000      -1.343200     -0.1144000    
 N    3.460400      0.4338000     -0.2006000    
 C    1.154800     -0.3011000     -0.5063000    
 C   0.5576000       1.064300     -0.1317000    
 C  -0.8714000      0.6861000     -6.4700000E-02
 C    2.492200     -0.5573000      0.1690000    
 C  -0.9834000     -0.6954000     -3.3000000E-02
 C   -1.992100       1.491000      2.4900001E-02
 C   -2.205300      -1.327600      9.1899998E-02
 C   -3.240500      0.8734000      0.1388000    
 C   -3.346000     -0.5271000      0.1735000    
 C    4.751100      0.2030000      0.4526000    
 H    1.266500     -0.3745000      -1.598000    
 H   0.7687000       1.820900     -0.8927000    
 H   0.8934000       1.417000      0.8493000    
 H    2.836300      -1.563300     -0.1046000    
 H    2.346100     -0.5766000       1.257000    
 H   -1.910300       2.572400      1.4700000E-02
 H    3.592600      0.4363000      -1.211500    
 H   -2.282600      -2.408500      0.1227000    
 H   -4.138500       1.481100      0.2090000    
 H   -4.324800     -0.9895000      0.2683000    
 H    5.453300      0.9875000      0.1542000    
 H    5.177300     -0.7628000      0.1627000    
 H    4.653500      0.2422000       1.542300    


%chk=000029939-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000029939

0 1
O 0.158006 -1.317749 -1.014098
N 3.458035 0.304344 -0.155877
C 1.250656 -0.276002 -1.112341
C 0.559232 1.103275 -0.905765
C -0.772495 0.715689 -0.276807
C 2.297932 -0.599701 -0.028177
C -0.941724 -0.684183 -0.401222
C -1.789863 1.486152 0.311700
C -2.099539 -1.351814 0.032269
C -2.969597 0.838675 0.766674
C -3.118717 -0.562144 0.622592
C 4.404027 0.262548 0.976580
H 1.687166 -0.394965 -2.119990
H 0.402687 1.627469 -1.867554
H 1.195451 1.746090 -0.273191
H 2.556339 -1.683422 -0.095332
H 1.839221 -0.437419 0.966876
H -1.679397 2.571602 0.416069
H 3.936081 0.181504 -1.058788
H -2.201832 -2.434859 -0.080877
H -3.769592 1.425928 1.230099
H -4.034600 -1.049338 0.975897
H 5.243983 0.952984 0.783134
H 4.826635 -0.749595 1.186959
H 3.893304 0.607029 1.894571


