%chk=000017858.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000017858

0 1
 O   -6.341100     -0.2250000     -0.4243000    
 C   -5.217600      7.4199997E-02  0.4139000    
 C   -3.965500     -0.6707000      6.7900002E-02
 C   -2.712500      0.1329000      0.4170000    
 C   -5.796400       1.097400     -0.5196000    
 C   -1.439200     -0.6184000      2.3700001E-02
 C  -0.1896000      0.2058000      0.3410000    
 C    1.113400     -0.4686000     -9.8499998E-02
 C    2.365300      0.3444000      0.2421000    
 C    3.634900     -0.3833000     -0.2092000    
 C    4.923500      0.3702000      0.1329000    
 C    6.187300     -0.3198000     -0.3818000    
 C    7.437500      0.4608000     -5.2000000E-03
 H   -5.387200      0.1791000       1.476600    
 H   -3.954900     -0.9185000      -1.001000    
 H   -3.960100      -1.621600      0.6138000    
 H   -2.743300       1.101300     -9.7599998E-02
 H   -2.701100      0.3484000       1.492600    
 H   -5.251800       1.351100      -1.419700    
 H   -6.374100       1.907200     -9.3400002E-02
 H   -1.393000      -1.576000      0.5558000    
 H   -1.462900     -0.8445000      -1.049200    
 H  -0.2648000       1.183500     -0.1512000    
 H  -0.1493000      0.3976000       1.420400    
 H    1.182200      -1.454100      0.3788000    
 H    1.078300     -0.6431000      -1.181000    
 H    2.406900      0.5185000       1.323800    
 H    2.310800       1.326100     -0.2430000    
 H    3.590400     -0.5423000      -1.293900    
 H    3.670100      -1.376800      0.2550000    
 H    4.989800      0.4870000       1.221800    
 H    4.869100       1.381100     -0.2903000    
 H    6.137700     -0.4200000      -1.472000    
 H    6.253300      -1.331200      3.5300002E-02
 H    7.415000       1.468100     -0.4332000    
 H    7.531400      0.5507000       1.081700    
 H    8.329900     -4.8700001E-02 -0.3822000    


%chk=000017858-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000017858

0 1
O -6.590226 -0.399100 -0.100590
C -5.277520 0.064665 0.500274
C -4.018888 -0.604965 -0.015569
C -2.741038 0.188793 0.352624
C -6.084097 1.001928 -0.346876
C -1.445197 -0.521864 -0.097894
C -0.163975 0.266076 0.255247
C 1.133644 -0.460650 -0.164528
C 2.416975 0.328579 0.179262
C 3.714590 -0.411581 -0.217058
C 4.999216 0.378558 0.119992
C 6.296666 -0.369653 -0.263367
C 7.575146 0.428261 0.073160
H -5.336077 0.193189 1.591717
H -4.093059 -0.717377 -1.114607
H -3.955374 -1.628530 0.405031
H -2.788450 1.197391 -0.106763
H -2.706548 0.347426 1.450823
H -5.760764 1.196724 -1.378226
H -6.675342 1.797302 0.124338
H -1.398888 -1.527082 0.370785
H -1.481609 -0.692311 -1.194099
H -0.200006 1.263490 -0.230871
H -0.139509 0.454462 1.349174
H 1.171829 -1.454170 0.329481
H 1.106894 -0.658291 -1.256718
H 2.435635 0.540775 1.268977
H 2.388053 1.315445 -0.328502
H 3.694263 -0.629971 -1.305546
H 3.745022 -1.395721 0.296044
H 5.016685 0.605414 1.206840
H 4.975654 1.358771 -0.400947
H 6.277329 -0.598925 -1.348583
H 6.320525 -1.347361 0.259984
H 7.588455 1.397623 -0.460260
H 7.634606 0.642414 1.157160
H 8.487779 -0.126936 -0.212110


