%chk=000047416.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000047416

0 1
 O   -4.995200      0.1054000     -0.3943000    
 C   -4.020100     -0.8531000     -0.6761000    
 C   -3.856100      0.2946000      0.4123000    
 C   -3.510000      -2.036000      4.7499999E-02
 C   -2.428700      0.6918000      0.2069000    
 C   -1.966800      -1.825900      0.2236000    
 C   -1.459600     -0.3614000      0.1967000    
 C  -7.2700001E-02 -6.0500000E-02  0.1157000    
 C   -2.008600       2.014900      0.1087000    
 C   0.3197000       1.296000      1.7800000E-02
 C  -0.6511000       2.310800      8.6000003E-03
 C   0.9447000      -1.042600      0.1245000    
 C    1.682500       1.627100     -7.1199998E-02
 C    2.308600     -0.7117000      3.6200002E-02
 C    2.682200      0.6427000     -6.3900001E-02
 C    3.307400      -1.700300      4.5699999E-02
 C    4.044100      0.9771000     -0.1528000    
 C    4.655700      -1.353500     -4.3200001E-02
 C    5.023800     -1.5600000E-02 -0.1427000    
 H   -3.577800     -0.7700000      -1.663700    
 H   -4.085000      0.1064000       1.459300    
 H   -3.695300      -2.956700     -0.5163000    
 H   -3.989800      -2.163900       1.025600    
 H   -1.485100      -2.348200     -0.6134000    
 H   -1.643200      -2.308000       1.153200    
 H   -2.734600       2.823300      0.1244000    
 H  -0.3545000       3.355900     -6.4900003E-02
 H   0.6768000      -2.095400      0.2064000    
 H    1.972900       2.675500     -0.1475000    
 H    3.042100      -2.752800      0.1225000    
 H    4.353700       2.017400     -0.2307000    
 H    5.417000      -2.127900     -3.4899998E-02
 H    6.073000      0.2562000     -0.2120000    


%chk=000047416-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000047416

0 1
O -5.155549 0.107732 -0.365383
C -4.032498 -0.911356 -0.548584
C -3.815644 0.224326 0.381264
C -3.524362 -2.185659 0.090785
C -2.441094 0.772673 0.141832
C -1.965500 -1.815300 0.181118
C -1.526264 -0.312592 0.132307
C -0.104427 -0.014739 0.076561
C -2.011538 2.135851 0.074568
C 0.326993 1.383627 -0.003434
C -0.657415 2.434397 -0.010693
C 0.896534 -1.022410 0.089688
C 1.709435 1.687201 -0.069205
C 2.278864 -0.716274 0.023886
C 2.700453 0.677313 -0.058697
C 3.289847 -1.743958 0.037810
C 4.108687 0.977276 -0.123975
C 4.641015 -1.417901 -0.026582
C 5.055604 -0.041827 -0.108562
H -3.625480 -0.763641 -1.559893
H -4.023478 0.022069 1.443032
H -3.658832 -3.103296 -0.508919
H -3.949944 -2.354156 1.094690
H -1.451079 -2.325382 -0.656810
H -1.558216 -2.267964 1.106678
H -2.766922 2.927945 0.081382
H -0.316791 3.474353 -0.074698
H 0.609169 -2.076935 0.157714
H 2.017354 2.738879 -0.129113
H 2.974963 -2.792663 0.100025
H 4.422135 2.026313 -0.186307
H 5.400086 -2.207742 -0.015647
H 6.123893 0.195441 -0.158837


