%chk=000012729.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000012729

0 1
 O   -5.243200     -0.5044000     -1.1900000E-02
 O   -4.216500       1.560400     -5.6200001E-02
 C   0.8968000      0.3974000     -1.7800000E-02
 C    2.171700     -0.4488000      1.8999999E-02
 C  -0.3550000     -0.4823000     -4.0800001E-02
 C    3.420300      0.4340000      7.4199997E-02
 C   -1.629700      0.3671000     -4.4100001E-02
 C    4.726800     -0.3626000      0.1438000    
 C   -2.899000     -0.4845000     -3.3399999E-02
 C    5.973700      0.5218000      0.2242000    
 C   -4.168600      0.3381000     -4.5200001E-02
 C    7.221700     -0.3083000      0.3030000    
 C   -6.524900      0.1321000      1.1700000E-02
 C    8.228600     -0.2295000     -0.5738000    
 C   -7.602600     -0.9305000      4.7300000E-02
 H   0.9090000       1.043900     -0.9036000    
 H   0.8671000       1.053100      0.8610000    
 H    2.151600      -1.107300      0.8957000    
 H    2.215200      -1.091700     -0.8683000    
 H  -0.3392000      -1.125000     -0.9292000    
 H  -0.3580000      -1.140900      0.8362000    
 H    3.443600       1.084100     -0.8092000    
 H    3.358500       1.092100      0.9498000    
 H   -1.631300       1.030200      0.8303000    
 H   -1.633800       1.017700     -0.9278000    
 H    4.795200      -1.011600     -0.7389000    
 H    4.692100      -1.025700       1.018100    
 H   -2.909800      -1.134100     -0.9160000    
 H   -2.909500      -1.110300      0.8663000    
 H    5.918800       1.154300       1.118200    
 H    6.004400       1.193400     -0.6421000    
 H    7.310500      -1.000600       1.136300    
 H   -6.642800      0.7490000     -0.8862000    
 H   -6.601200      0.7666000      0.9018000    
 H    9.108900     -0.8520000     -0.4565000    
 H    8.194300      0.4503000      -1.417800    
 H   -7.527900      -1.584500     -0.8278000    
 H   -7.487000      -1.567200      0.9306000    
 H   -8.597800     -0.4777000      6.6000000E-02


%chk=000012729-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000012729

0 1
O -5.330120 -0.533283 -0.041942
O -4.333264 1.561767 0.177357
C 0.904256 0.430453 0.072212
C 2.207298 -0.399450 0.109537
C -0.373025 -0.438950 0.093578
C 3.485511 0.468659 0.089652
C -1.670857 0.397171 0.056596
C 4.786307 -0.364133 0.132818
C -2.933476 -0.485586 0.076078
C 6.066747 0.513702 0.108099
C -4.224591 0.317728 0.078079
C 7.337867 -0.300924 0.223119
C -6.672235 0.127601 -0.035587
C 8.349085 -0.318022 -0.681850
C -7.709095 -0.981523 -0.181588
H 0.899850 1.065862 -0.837899
H 0.887677 1.126642 0.936503
H 2.210901 -1.035331 1.019700
H 2.223866 -1.095375 -0.755222
H -0.354334 -1.135603 -0.770930
H -0.366570 -1.073779 1.004752
H 3.484985 1.102167 -0.821878
H 3.468622 1.166906 0.952781
H -1.696775 1.092394 0.917196
H -1.680831 1.033839 -0.849222
H 4.811323 -1.064385 -0.725974
H 4.790810 -0.991769 1.048309
H -2.954887 -1.173581 -0.790968
H -2.939612 -1.137728 0.972617
H 6.011646 1.232263 0.953989
H 6.088170 1.115965 -0.821182
H 7.418895 -0.931630 1.123744
H -6.706174 0.853392 -0.868336
H -6.780168 0.687907 0.910961
H 9.241383 -0.938031 -0.537971
H 8.311555 0.290214 -1.594591
H -7.564407 -1.534002 -1.125702
H -7.639826 -1.698391 0.654461
H -8.725509 -0.547060 -0.184394


