%chk=000176435.chk
%nprocshared=4
%mem=3800MB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000176435

0 1
 O   0.4267000      -2.172000     -0.1123000    
 O  -1.1900000E-02   2.340000      0.9290000    
 N  -0.2431000      5.5300001E-02  0.3374000    
 C    1.930300     -0.5733000      0.9004000    
 C    1.909400      0.9282000      0.6300000    
 C    3.164000      -1.315000      0.3997000    
 C    2.472500       1.339200     -0.7338000    
 C    3.609500     -0.8788000     -0.9912000    
 C    3.779500      0.6326000      -1.062500    
 C   0.6205000      -1.037600      0.3005000    
 C   0.4292000       1.230300      0.6636000    
 C   -1.644800     -1.9200001E-02  5.9999999E-02
 C   -2.353200      -1.190500      0.3373000    
 C   -2.310100       1.079600     -0.4882000    
 C   -3.720000      -1.262700      6.7699999E-02
 C   -3.676800       1.007600     -0.7577000    
 C   -4.381700     -0.1636000     -0.4798000    
 H    1.833900     -0.7531000       1.980900    
 H    2.424000       1.462700       1.436000    
 H    2.994400      -2.397900      0.4035000    
 H    3.988300      -1.126200       1.099700    
 H    2.626300       2.425300     -0.7504000    
 H    1.746600       1.130400      -1.531300    
 H    2.875300      -1.206000      -1.737300    
 H    4.557900      -1.367800      -1.241200    
 H    4.561500      0.9540000     -0.3639000    
 H    4.109200      0.9193000      -2.067500    
 H   -1.877200      -2.054800      0.7907000    
 H   -1.788700       1.996400     -0.7457000    
 H   -4.270600      -2.172100      0.2900000    
 H   -4.191200       1.860800      -1.190200    
 H   -5.445800     -0.2197000     -0.6897000    


%chk=000176435-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000176435

0 1
O 0.314478 -2.237537 -0.053166
O -0.092435 2.374636 0.841111
N -0.271306 0.045333 0.338241
C 1.970083 -0.611277 0.872230
C 1.930004 0.927461 0.667090
C 3.195947 -1.370983 0.318880
C 2.529283 1.385710 -0.703463
C 3.677431 -0.842252 -1.050395
C 3.872157 0.689577 -1.007349
C 0.618803 -1.080238 0.314106
C 0.435287 1.253016 0.664076
C -1.685655 -0.026840 0.064411
C -2.421727 -1.172863 0.455208
C -2.334921 1.047403 -0.593102
C -3.804192 -1.239897 0.182450
C -3.719716 0.970783 -0.852226
C -4.460313 -0.170670 -0.469256
H 1.906627 -0.812981 1.963302
H 2.430992 1.474345 1.483317
H 2.939936 -2.444844 0.254191
H 4.023503 -1.275122 1.048950
H 2.632896 2.485450 -0.690442
H 1.817961 1.138917 -1.518204
H 2.938085 -1.095719 -1.836796
H 4.621836 -1.348203 -1.325038
H 4.621462 0.949864 -0.231610
H 4.266426 1.057980 -1.973214
H -1.918285 -2.006387 0.949972
H -1.770275 1.936942 -0.880532
H -4.367794 -2.129731 0.482995
H -4.218094 1.805793 -1.356376
H -5.534584 -0.226264 -0.675663


