%chk=000016819.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000016819

0 1
 O   -3.937900      -1.951100      5.0000002E-04
 O   -5.442000      0.2482000      1.2000001E-03
 C   0.1148000      0.6704000       0.000000    
 C   0.9261000     -0.5055000     -9.9999997E-05
 C   -1.316800      0.5571000     -3.0000001E-04
 C    2.368000     -0.4056000     -1.9999999E-04
 C   -1.905700     -0.7183000     -3.0000001E-04
 C    2.974400      0.8732000      1.9999999E-04
 C   0.2622000      -1.752800     -3.0000001E-04
 C   0.7869000       1.911400      5.0000002E-04
 C   -1.124600      -1.865000     -9.9999997E-05
 C    2.176500       2.012000      6.9999998E-04
 C   -2.211900       1.734900     -8.9999998E-04
 C    3.254500      -1.515700     -9.9999997E-05
 C   -3.374400     -0.8679000     -9.9999997E-05
 C    4.373500       1.013200      9.9999997E-05
 C   -3.547100       1.665700     -8.9999998E-04
 C   -4.226600      0.3641000       0.000000    
 C    4.644900      -1.367400       0.000000    
 C    5.205200     -0.1009000       0.000000    
 H   0.8158000      -2.688200     -3.0000001E-04
 H   0.2458000       2.853400      7.9999998E-04
 H   -1.569200      -2.856500     -9.9999997E-05
 H    2.622700       3.005000      1.0000000E-03
 H   -1.777800       2.726900     -1.6000000E-03
 H    2.879900      -2.536000     -9.9999997E-05
 H    4.830800       2.001200      3.0000001E-04
 H   -4.158300       2.560700     -1.3000000E-03
 H    5.283300      -2.246100       0.000000    
 H    6.283700      2.1700000E-02   0.000000    


%chk=000016819-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000016819

0 1
O -3.956564 -2.037043 -0.000009
O -5.545730 0.307558 0.000543
C 0.117372 0.677565 -0.000158
C 0.934425 -0.521089 -0.000091
C -1.323254 0.560055 -0.000309
C 2.396290 -0.408444 0.000006
C -1.922750 -0.730966 -0.000283
C 3.001608 0.900428 0.000096
C 0.282745 -1.791611 -0.000099
C 0.778510 1.964982 -0.000015
C -1.109795 -1.896090 -0.000160
C 2.155263 2.069455 0.000115
C -2.194585 1.740476 -0.000403
C 3.262859 -1.545645 0.000019
C -3.406440 -0.899353 -0.000443
C 4.423586 1.029766 0.000183
C -3.566968 1.672635 -0.000323
C -4.282332 0.388765 -0.000275
C 4.656886 -1.399200 0.000105
C 5.246372 -0.102634 0.000187
H 0.875755 -2.709612 -0.000064
H 0.185531 2.882815 0.000063
H -1.608213 -2.870682 -0.000167
H 2.631220 3.057080 0.000253
H -1.732015 2.732050 -0.000471
H 2.846288 -2.556893 -0.000041
H 4.862118 2.034469 0.000251
H -4.184565 2.577366 -0.000279
H 5.296795 -2.288126 0.000110
H 6.336286 0.004023 0.000257


