%chk=000005656.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000005656

0 1
 O   -1.392700      0.8058000      -1.466100    
 O    4.496900       1.323600      0.2106000    
 N   4.7699999E-02  -3.018300     -5.0700001E-02
 C   -1.771100      0.3789000     -0.1540000    
 C  -0.7728000     -0.6898000      0.2947000    
 C   -1.706200       1.598600      0.7781000    
 C   -3.196200     -0.1955000     -0.2056000    
 C   -2.752700       2.656600      0.4237000    
 C   -4.236800      0.8680000     -0.5593000    
 C   -4.158100       2.065600      0.3820000    
 C  -0.8659000      -1.987800     -0.5357000    
 C   0.6500000     -0.1464000      0.2719000    
 C    1.349800     -6.3900001E-02   1.457300    
 C    1.193100      0.2459000     -0.9336000    
 C  -1.6899999E-02  -4.204900     -0.9044000    
 C  -0.2642000      -3.370300       1.335000    
 C    2.652500      0.4340000       1.436400    
 C    2.496000      0.7437000     -0.9546000    
 C    3.225900      0.8377000      0.2305000    
 C    5.021700       1.718300      -1.056100    
 H   -1.046500     -0.9229000       1.332100    
 H  -0.7287000       2.091500      0.7228000    
 H   -1.858700       1.286700       1.819300    
 H   -3.458200     -0.6482000      0.7588000    
 H   -3.291200     -0.9679000     -0.9762000    
 H   -2.514000       3.102300     -0.5496000    
 H   -2.717500       3.467700       1.160000    
 H   -5.240200      0.4294000     -0.5118000    
 H   -4.087300       1.204600      -1.592500    
 H   -4.453200       1.755200       1.391900    
 H   -4.871900       2.833300      6.2700003E-02
 H   -1.883000      -2.393500     -0.5047000    
 H  -0.6460000      -1.780800      -1.590100    
 H   -1.663000      0.1238000      -2.103600    
 H   0.9133000     -0.3663000       2.403900    
 H   0.6980000      0.1257000      -1.889300    
 H   0.2476000      -3.951900      -1.937300    
 H   -1.013200      -4.662000     -0.9048000    
 H   0.7076000      -4.957300     -0.5736000    
 H   0.3324000      -4.236600       1.646800    
 H   -1.319800      -3.632800       1.471700    
 H   7.9999998E-04  -2.583000       2.043900    
 H    3.215400      0.5069000       2.363000    
 H    2.886200       1.024400      -1.927000    
 H    5.097600      0.8681000      -1.742400    
 H    6.040000       2.082600     -0.8848000    
 H    4.452800       2.549700      -1.486200    


%chk=000005656-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000005656

0 1
O -1.871973 0.470710 -1.685524
O 4.683190 1.309184 0.270170
N -0.152337 -3.137692 0.125219
C -1.874426 0.324034 -0.196737
C -0.748230 -0.686035 0.248492
C -1.622150 1.750971 0.343842
C -3.272994 -0.176215 0.272054
C -2.768292 2.733428 0.012776
C -4.413139 0.805342 -0.085659
C -4.137039 2.208233 0.501248
C -0.800733 -2.010020 -0.579380
C 0.672578 -0.122601 0.220197
C 1.499074 -0.194281 1.371287
C 1.225847 0.444998 -0.954761
C 0.423142 -4.144567 -0.786283
C -1.007096 -3.746366 1.160111
C 2.822415 0.285966 1.361198
C 2.550455 0.936698 -0.986214
C 3.353160 0.855893 0.178907
C 5.273272 1.903825 -0.928937
H -0.977095 -0.942438 1.302882
H -0.670973 2.127624 -0.069158
H -1.486035 1.679704 1.442526
H -3.241295 -0.305318 1.373429
H -3.485024 -1.177135 -0.155975
H -2.804929 2.876402 -1.083896
H -2.548750 3.719451 0.466439
H -5.376019 0.406178 0.288591
H -4.498115 0.885566 -1.187520
H -4.138713 2.148910 1.610277
H -4.944165 2.910039 0.214964
H -1.860015 -2.269996 -0.846131
H -0.260480 -1.843856 -1.528901
H -2.243344 -0.360709 -2.078270
H 1.102770 -0.645666 2.288850
H 0.598053 0.528065 -1.849403
H 1.137160 -3.657058 -1.472651
H -0.341322 -4.686043 -1.401973
H 0.977395 -4.899535 -0.199462
H -0.426980 -4.494024 1.730149
H -1.912255 -4.257863 0.739178
H -1.355792 -2.977997 1.872323
H 3.460410 0.226574 2.248422
H 2.937981 1.377154 -1.910285
H 5.310597 1.177518 -1.764885
H 6.296102 2.185911 -0.637908
H 4.715412 2.805538 -1.250519


