%chk=000008528.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000008528

0 1
 O  -0.8539000      0.9706000     -0.2733000    
 O   0.3550000      -1.854800     -0.8663000    
 O    3.405300      -1.679600       1.015100    
 O  -0.2325000       2.811600      -1.526900    
 O    1.027000      -2.875200       1.091600    
 N   -3.738400     -0.1889000      0.3266000    
 C   -2.710000     -0.5739000     -0.6877000    
 C   -2.014900      0.7343000      -1.093200    
 C   -3.093800       1.771600     -0.7911000    
 C   -3.676300       1.262200      0.5173000    
 C   -1.920300      -1.682700     -6.6100001E-02
 C   -3.447400     -0.9615000       1.548600    
 C   -2.351300      -1.904000       1.180000    
 C  -0.9250000      -2.504500     -0.8109000    
 C    2.429600      5.2000001E-02 -0.4171000    
 C    2.591000      -1.469000     -0.1356000    
 C    1.747000      0.7955000      0.7641000    
 C  -5.9500001E-02   2.024200     -0.6083000    
 C    1.089700       2.079300      0.3291000    
 C    1.246900      -2.151400      0.1278000    
 C    3.772000      0.7321000     -0.7372000    
 C    3.264400      -2.220800      -1.289100    
 C    1.481100       3.295700      0.7323000    
 C    2.614300       3.537200       1.670000    
 H   -3.263700     -0.9628000      -1.552400    
 H   -1.723500      0.7231000      -2.149600    
 H   -3.858500       1.766100      -1.577500    
 H   -2.713400       2.790100     -0.6779000    
 H   -3.012900       1.552100       1.341800    
 H   -4.668500       1.680300      0.7109000    
 H   -4.341600      -1.518900       1.845500    
 H   -3.132000     -0.3422000       2.395500    
 H   -1.980700      -2.679300       1.835000    
 H  -0.8286000      -3.509400     -0.3814000    
 H   -1.262200      -2.648400      -1.843300    
 H    1.803400      0.1582000      -1.313200    
 H    2.468800      0.9374000       1.574900    
 H   0.9679000      0.1673000       1.212400    
 H    4.232600      0.3022000      -1.631700    
 H    3.636700       1.799600     -0.9384000    
 H    4.479100      0.6328000      9.2900001E-02
 H    3.222300      -3.305300      -1.128200    
 H    2.777200      -2.011200      -2.247200    
 H    4.327200      -1.969000      -1.369100    
 H    3.555500      -2.635300       1.114500    
 H   0.9486000       4.181900      0.3947000    
 H    3.044800       4.523700       1.464500    
 H    3.432200       2.820500       1.563600    
 H    2.260500       3.538500       2.705200    


%chk=000008528-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000008528

0 1
O -0.885548 0.921998 -0.248613
O 0.398308 -1.950320 -1.075774
O 3.357240 -1.682727 1.081074
O -0.425616 2.961898 -1.293171
O 0.924458 -2.843213 1.014575
N -3.700619 -0.245732 0.412277
C -2.767445 -0.594878 -0.717635
C -2.088382 0.747387 -1.115474
C -3.192398 1.773744 -0.771928
C -3.791252 1.232816 0.549074
C -1.937180 -1.746984 -0.164046
C -3.341193 -1.034833 1.621876
C -2.274350 -1.989827 1.130980
C -0.984283 -2.572397 -0.977167
C 2.432119 0.051653 -0.413353
C 2.608239 -1.482537 -0.167898
C 1.697782 0.721568 0.796058
C -0.101909 2.069325 -0.467894
C 1.120006 2.068665 0.402559
C 1.228007 -2.154756 0.004045
C 3.786197 0.740355 -0.685184
C 3.365522 -2.195851 -1.314887
C 1.629105 3.297870 0.723205
C 2.831019 3.596756 1.580597
H -3.334853 -0.929314 -1.616028
H -1.761904 0.797010 -2.169034
H -3.949634 1.748099 -1.577910
H -2.804236 2.799501 -0.698986
H -3.192071 1.591762 1.417843
H -4.834161 1.569562 0.694523
H -4.213611 -1.577462 2.042068
H -2.946934 -0.381545 2.437664
H -1.833058 -2.772956 1.753947
H -0.857179 -3.578179 -0.542851
H -1.280896 -2.641377 -2.036501
H 1.787649 0.150042 -1.309569
H 2.412044 0.811656 1.631404
H 0.873788 0.070203 1.139859
H 4.232955 0.410041 -1.639204
H 3.648140 1.834226 -0.747009
H 4.498815 0.518377 0.129443
H 3.362953 -3.288876 -1.157651
H 2.909640 -1.974549 -2.295476
H 4.414369 -1.859197 -1.313163
H 2.802436 -2.265929 1.670582
H 1.101490 4.172114 0.313002
H 3.582530 4.169342 1.001421
H 3.320044 2.691044 1.972611
H 2.545056 4.238424 2.436920


