%chk=000029488.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000029488

0 1
 O    1.808700     -0.1970000     -0.9670000    
 O   -3.298600      -1.526400      0.6276000    
 O    2.379700      0.1007000       1.267200    
 N    3.946100      0.4265000     -0.4129000    
 C   -2.737600       1.222400      9.1300003E-02
 C   -1.714500      0.1433000     -4.1400000E-02
 C   -3.023000       1.928900      -1.246800    
 C   -2.359100       2.262300       1.162100    
 C   -2.040300      -1.185100      0.2318000    
 C  -0.4210000      0.4755000     -0.4442000    
 C   0.5467000     -0.5207000     -0.5737000    
 C   -1.072600      -2.181300      0.1025000    
 C   0.2209000      -1.849100     -0.3003000    
 C    2.696800      0.1126000      8.1299998E-02
 C    5.067800      0.7874000      0.4224000    
 H   -3.694200      0.7938000      0.4143000    
 H   -3.315800       1.204100      -2.014600    
 H   -2.149600       2.476100      -1.617300    
 H   -3.841900       2.647800      -1.134200    
 H   -2.174400       1.777300       2.127100    
 H   -3.171000       2.984900       1.299200    
 H   -1.458200       2.822900      0.8903000    
 H  -0.1500000       1.505500     -0.6619000    
 H   -1.312400      -3.220300      0.3123000    
 H   0.9698000      -2.630100     -0.3996000    
 H   -3.336500      -2.487600      0.7709000    
 H    4.084700      0.4021000      -1.418500    
 H    4.796900      0.7771000       1.480700    
 H    5.399600       1.787800      0.1341000    
 H    5.873600      7.2700001E-02  0.2386000    


%chk=000029488-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000029488

0 1
O 1.863047 0.457891 -0.064855
O -3.379598 -1.498357 0.598858
O 3.280542 -1.439820 0.263821
N 4.091918 0.711040 -0.218719
C -3.016912 1.195438 -0.247998
C -1.831210 0.260928 -0.000920
C -2.855889 2.051973 -1.527202
C -3.254667 2.096519 0.997153
C -2.039149 -1.076494 0.437472
C -0.494760 0.692022 -0.147375
C 0.592657 -0.167666 0.122016
C -0.951161 -1.937741 0.700953
C 0.381681 -1.497005 0.548836
C 3.107549 -0.220485 0.018618
C 5.512939 0.358899 -0.210495
H -3.912243 0.559111 -0.369567
H -2.674517 1.419181 -2.414679
H -2.016344 2.767218 -1.440950
H -3.773333 2.642880 -1.705933
H -3.422766 1.485012 1.901499
H -4.140466 2.741605 0.845880
H -2.380284 2.748839 1.182430
H -0.277641 1.711637 -0.480404
H -1.134253 -2.969095 1.031123
H 1.223339 -2.161598 0.743707
H -3.410409 -2.445478 0.881546
H 3.794135 1.668157 -0.407396
H 5.595535 -0.715805 0.016451
H 6.062833 0.927201 0.562324
H 5.980027 0.548092 -1.194894


