%chk=000051976.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000051976

0 1
 O   -2.985800     -0.5033000      1.2200000E-02
 O    5.696700     -0.6030000     -7.7000000E-03
 O   -5.590800      -1.187800     -1.2300000E-02
 C    1.048300      0.5507000      3.3000000E-03
 C   0.6737000     -0.8141000      3.8000001E-03
 C    2.411400      0.8888000     -1.9999999E-04
 C  -0.6893000      -1.152300      7.1999999E-03
 C    3.391100     -0.1045000     -3.3000000E-03
 C    1.673300      -1.800500      3.9999999E-04
 C   -1.669000     -0.1591000      1.0400000E-02
 C   4.8599999E-02   1.537100      6.3999998E-03
 C    3.022700      -1.446500     -3.0000000E-03
 C   -1.300800       1.183000      9.8999999E-03
 C    4.798700      0.2624000     -6.0000001E-03
 C   -3.935400      0.5616000      1.3600000E-02
 C    5.210100       1.730600     -6.3000000E-03
 C   -5.348200      1.8100001E-02 -7.3000002E-03
 C   -6.455200       1.038700     -2.1199999E-02
 H    2.677800       1.942700     -3.0000001E-04
 H  -0.9942000      -2.197300      7.3000002E-03
 H    1.408200      -2.855800      6.9999998E-04
 H   0.3139000       2.592500      6.3999998E-03
 H    3.767400      -2.238100     -5.2000000E-03
 H   -2.007700       2.005600      1.3800000E-02
 H   -3.840300       1.157000      0.9293000    
 H   -3.825400       1.173200     -0.8899000    
 H    4.845700       2.226000      0.8974000    
 H    4.841000       2.227000     -0.9075000    
 H    6.302900       1.795500     -9.2000002E-03
 H   -7.424100      0.5318000     -3.3500001E-02
 H   -6.392700       1.659300      0.8761000    
 H   -6.370100       1.659600     -0.9165000    


%chk=000051976-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000051976

0 1
O -3.023252 -0.438793 0.001492
O 5.759781 -0.760925 -0.003356
O -5.592088 -1.336325 0.002256
C 1.089087 0.634834 0.001289
C 0.659754 -0.752253 -0.001138
C 2.487010 0.935485 0.001234
C -0.732190 -1.052931 -0.001171
C 3.450320 -0.085159 -0.001103
C 1.665571 -1.782119 -0.003522
C -1.681925 -0.022585 0.001232
C 0.090514 1.660642 0.003708
C 3.016531 -1.459924 -0.003507
C -1.270823 1.351932 0.003745
C 4.924056 0.192769 -0.001167
C -4.057172 0.579548 0.000864
C 5.407921 1.641062 0.001479
C -5.440532 -0.094972 -0.001207
C -6.612062 0.883085 -0.009078
H 2.793129 1.988292 0.003087
H -1.080832 -2.090437 -0.002989
H 1.346139 -2.830593 -0.005353
H 0.407769 2.710288 0.005636
H 3.792311 -2.232301 -0.005270
H -2.009400 2.158797 0.005773
H -3.984249 1.230756 0.899550
H -3.981511 1.232468 -0.896272
H 5.043059 2.181329 0.894880
H 5.041712 2.185163 -0.889028
H 6.508221 1.649340 0.000695
H -7.559622 0.324011 -0.004428
H -6.577314 1.546914 0.875765
H -6.577412 1.531504 -0.905294


