%chk=000042620.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000042620

0 1
 O   -2.954300       1.644600      -1.535000    
 O   -4.357200      0.8556000       1.697900    
 C   -1.698400      0.2349000     -0.1038000    
 C   0.6931000     -0.3102000     -2.6799999E-02
 C  -0.3384000      0.6651000     -5.7500001E-02
 C   -2.850500       1.227100     -0.1733000    
 C   -1.996400      -1.143400     -0.1522000    
 C    2.060400      7.8500003E-02  3.0999999E-02
 C   0.3737000      -1.687100     -6.0199998E-02
 C   -4.210300      0.6703000      0.2900000    
 C  -0.9644000      -2.086100     -0.1307000    
 C    2.409700       1.446500      5.2000001E-02
 C    3.083400     -0.9001000      6.5200001E-02
 C   5.4499999E-02   2.021200     -4.7300000E-02
 C   -3.381700      -1.616300     -0.2367000    
 C   -4.403700     -0.7826000     -1.5000000E-02
 C    1.399000      -2.641600     -2.7500000E-02
 C    1.396500       2.404800      9.1000004E-03
 C    2.736200      -2.254200      3.6600001E-02
 C    3.760700       1.819700      0.1112000    
 C    4.426200     -0.4992000      0.1247000    
 C    4.761600      0.8524000      0.1483000    
 H   -2.618900       2.106300      0.4375000    
 H   -5.020900       1.228400     -0.1943000    
 H   -1.206300      -3.148100     -0.1651000    
 H  -0.6814000       2.820500     -8.7399997E-02
 H   -3.565400      -2.665500     -0.4422000    
 H   -5.419200      -1.167500     -4.0199999E-02
 H    1.166700      -3.704700     -5.2000001E-02
 H    1.635700       3.466300      1.7300000E-02
 H    3.503700      -3.025000      6.1099999E-02
 H    4.045500       2.869600      0.1282000    
 H    5.224700      -1.237700      0.1523000    
 H   -3.620600       2.351700      -1.574700    
 H    5.804600       1.151900      0.1941000    
 H   -4.329300       1.811800       1.872300    


%chk=000042620-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000042620

0 1
O -2.902250 1.680598 -1.594629
O -4.382103 0.819447 1.764790
C -1.711199 0.227151 -0.110600
C 0.705982 -0.334341 -0.030388
C -0.351238 0.652228 -0.062375
C -2.843953 1.234571 -0.177622
C -2.021051 -1.163931 -0.161335
C 2.083249 0.071974 0.032433
C 0.377730 -1.738446 -0.073104
C -4.227816 0.699508 0.291797
C -0.982105 -2.122564 -0.148363
C 2.425082 1.472671 0.056464
C 3.132879 -0.918710 0.068312
C 0.029257 2.052274 -0.061433
C -3.422995 -1.605213 -0.215482
C -4.466170 -0.753243 -0.027193
C 1.447905 -2.712571 -0.040282
C 1.353845 2.442766 -0.000272
C 2.771476 -2.319453 0.030870
C 3.791432 1.855824 0.123430
C 4.487381 -0.493057 0.136231
C 4.810794 0.880222 0.164871
H -2.611045 2.108184 0.472625
H -5.005180 1.325365 -0.207064
H -1.236057 -3.189265 -0.186300
H -0.751625 2.813727 -0.139449
H -3.608699 -2.672231 -0.390931
H -5.502120 -1.106842 -0.028244
H 1.184703 -3.776342 -0.071773
H 1.615618 3.507590 -0.003593
H 3.573640 -3.066261 0.058182
H 4.048537 2.921412 0.140742
H 5.283533 -1.246235 0.164759
H -3.642592 2.336869 -1.692342
H 5.859809 1.191264 0.216979
H -4.396057 1.782956 2.007187


