%chk=000027233.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000027233

0 1
 O    3.617600       1.179200     -7.1500003E-02
 O    1.888600      8.3899997E-02   1.814300    
 N    2.487900      -4.275500     -0.1310000    
 C  -0.7448000       2.847100      0.4439000    
 C   0.4726000       2.740300     -0.4785000    
 C   -1.971700       2.181000     -0.1846000    
 C    1.735500       3.380800      0.1044000    
 C   -3.219200       2.236700      0.7055000    
 C    2.931500       3.340000     -0.8453000    
 C   -4.479200       1.595800      0.1112000    
 C    3.281400       1.911700      -1.241800    
 C   -4.345800      0.1172000     -0.1541000    
 C   -4.689000     -0.8030000      0.8365000    
 C   -3.878600     -0.3302000      -1.390000    
 C    3.334100     -0.1618000     -7.8400001E-02
 C   -4.565200      -2.170500      0.5911000    
 C   -3.755000      -1.697800      -1.635400    
 C   -4.098200      -2.617800     -0.6450000    
 C    2.466600     -0.7074000      0.8681000    
 C    3.920100     -0.9822000      -1.042200    
 C    2.185600      -2.073700      0.8507000    
 C    3.639200      -2.348200      -1.059600    
 C    2.771900      -2.894000     -0.1132000    
 C    1.014300     -0.5517000       2.744800    
 H  -0.9624000       3.902300      0.6471000    
 H  -0.5195000       2.370400       1.405400    
 H   0.6469000       1.677400     -0.6762000    
 H   0.2402000       3.212500      -1.441000    
 H   -2.194900       2.659900      -1.145800    
 H   -1.717400       1.136600     -0.3963000    
 H    1.989700       2.893500       1.053100    
 H    1.524500       4.429900      0.3461000    
 H   -2.989700       1.756400       1.665400    
 H   -3.443400       3.287200      0.9292000    
 H    2.718100       3.929500      -1.744000    
 H    3.788100       3.802300     -0.3407000    
 H   -4.748800       2.110200     -0.8203000    
 H   -5.322700       1.764400      0.7931000    
 H    4.161800       1.933400      -1.895000    
 H    2.469000       1.440900      -1.807400    
 H   -5.051800     -0.4667000       1.804100    
 H   -3.610100      0.3757000      -2.171500    
 H   -4.831700      -2.887200       1.362400    
 H   -3.391600      -2.046200      -2.597700    
 H   -4.001600      -3.682600     -0.8359000    
 H    4.603600     -0.5721000      -1.780700    
 H    1.519600      -2.554100       1.560100    
 H    4.103500      -2.977400      -1.814600    
 H    1.858800      -4.672900      0.5538000    
 H    2.912600      -4.870100     -0.8302000    
 H   0.1372000     -0.9792000       2.246800    
 H    1.544400      -1.285000       3.361900    
 H   0.6456000      0.2260000       3.421900    


%chk=000027233-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000027233

0 1
O 3.358286 1.046704 0.047490
O 1.074438 -0.531941 -0.398886
N 3.751989 -4.600701 0.373091
C -0.887695 3.222079 0.437986
C 0.261965 2.999570 -0.570787
C -2.223237 2.609977 -0.042616
C 1.636408 3.467498 -0.043020
C -3.347650 2.668382 1.013561
C 2.813546 3.171016 -1.004291
C -4.639959 1.906924 0.593252
C 3.040624 1.676201 -1.263185
C -4.427674 0.405343 0.443954
C -4.233261 -0.411177 1.590151
C -4.390140 -0.212854 -0.832598
C 3.432799 -0.364704 0.052243
C -4.005069 -1.799628 1.466002
C -4.162663 -1.603148 -0.964218
C -3.967522 -2.402460 0.185799
C 2.284930 -1.196565 -0.129901
C 4.665333 -0.978831 0.348333
C 2.398228 -2.601078 -0.028452
C 4.790171 -2.379008 0.465078
C 3.652203 -3.207246 0.270492
C -0.148774 -1.337806 -0.452862
H -1.016575 4.306474 0.638440
H -0.605740 2.755637 1.404973
H 0.314407 1.917019 -0.795495
H 0.028443 3.518615 -1.524885
H -2.558106 3.121248 -0.969850
H -2.043610 1.551424 -0.320159
H 1.842433 2.964515 0.921086
H 1.604492 4.557751 0.160627
H -2.971760 2.242569 1.966368
H -3.608162 3.725667 1.223325
H 2.638003 3.661930 -1.984317
H 3.745918 3.599922 -0.588197
H -5.012232 2.329532 -0.360434
H -5.422520 2.097056 1.354504
H 3.900214 1.518050 -1.947432
H 2.144926 1.192177 -1.693786
H -4.266519 0.046529 2.587045
H -4.544179 0.400309 -1.729201
H -3.864153 -2.412039 2.364243
H -4.144547 -2.060737 -1.960320
H -3.800520 -3.481318 0.087826
H 5.531515 -0.326715 0.502624
H 1.519312 -3.238726 -0.171242
H 5.761678 -2.826370 0.704829
H 2.940268 -5.195582 0.242022
H 4.641391 -5.039443 0.589023
H -0.126076 -2.052065 -1.299358
H -0.309501 -1.886355 0.494906
H -0.967877 -0.618719 -0.600782


