%chk=000165547.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000165547

0 1
 O   -2.669500       1.000100     -0.6044000    
 O    2.800600      -2.958200      -1.115400    
 O   -4.470800       1.689200      0.6366000    
 N   0.6887000      0.7275000      0.5882000    
 N    2.996300     -0.7053000     -0.5692000    
 N   -3.504500      -1.556200     -0.5924000    
 C    1.596000       1.044700      -1.730700    
 C    2.962100       1.698000      0.2173000    
 C   0.3330000      0.9425000     -0.8281000    
 C    2.572400       2.099100      -1.207100    
 C    3.729100      0.3450000      0.1704000    
 C    1.682900       1.685400       1.085100    
 C    2.337200     -0.3014000      -1.817300    
 C  -0.6053000       2.156600      -1.024800    
 C    4.180900     -0.1044000       1.561600    
 C  -0.4950000      0.6372000       1.448500    
 C   -1.847400       2.067700     -0.1381000    
 C   -1.454700       1.823300       1.317100    
 C    4.884100      -1.443400       1.449500    
 C    3.209000      -2.071900     -0.3595000    
 C    3.898200      -2.469300      0.9306000    
 C   -3.843000      0.7969000      7.5800002E-02
 C   -4.235900     -0.6125000      4.0700000E-02
 C   -5.334300      -1.172200      0.6059000    
 C   -4.134200      -2.764100     -0.4408000    
 C   -5.275900      -2.554500      0.3005000    
 H    1.282300       1.319900      -2.745600    
 H    3.638000       2.461800      0.6234000    
 H  -0.2203000      5.3100001E-02  -1.161800    
 H    3.460700       2.154600      -1.848600    
 H    2.121100       3.097100      -1.217100    
 H    4.639300      0.5099000     -0.4252000    
 H    1.948200       1.444700       2.120100    
 H    1.270600       2.701900       1.112400    
 H    1.648500      -1.088400      -2.145700    
 H    3.126900     -0.2401000      -2.577300    
 H  -8.2999997E-02   3.094200     -0.8055000    
 H  -0.9135000       2.195700      -2.077000    
 H    3.331700     -0.2131000       2.244700    
 H    4.857700      0.6398000       1.996200    
 H  -0.1927000      0.5230000       2.496800    
 H   -1.029700     -0.2888000       1.201700    
 H   -2.410500       3.004800     -0.2289000    
 H   -2.321400       1.638900       1.959500    
 H  -0.9722000       2.726100       1.711500    
 H    5.263300      -1.753400       2.429400    
 H    5.744800      -1.365200      0.7745000    
 H    3.113900      -2.652300       1.674900    
 H    4.421800      -3.417200      0.7619000    
 H   -2.638300      -1.407300      -1.092700    
 H   -6.102200     -0.6678000       1.175900    
 H   -3.714700      -3.662000     -0.8724000    
 H   -5.987700      -3.315100      0.5896000    


%chk=000165547-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000165547

0 1
O -2.531248 0.643609 -0.138413
O 2.091755 -2.785896 -0.530732
O -4.516518 1.545803 0.749827
N 0.908683 0.855498 0.739890
N 3.070395 -0.671527 -0.569330
N -3.656051 -1.761387 -0.628972
C 1.541697 0.981923 -1.693667
C 3.123163 1.783710 0.054225
C 0.388732 0.895235 -0.656236
C 2.539753 2.111472 -1.340382
C 3.907048 0.427169 -0.006112
C 1.955702 1.840516 1.071125
C 2.333785 -0.341293 -1.808409
C -0.671271 2.021202 -0.861659
C 4.547832 0.051824 1.345908
C -0.182529 0.727069 1.732739
C -1.802303 1.920942 0.176555
C -1.258402 1.842168 1.618487
C 4.997898 -1.420461 1.361176
C 2.902919 -1.939299 -0.027290
C 3.749474 -2.306803 1.192192
C -3.897806 0.582316 0.231321
C -4.439323 -0.733698 -0.084871
C -5.747678 -1.237812 0.073142
C -4.433664 -2.889208 -0.814955
C -5.744204 -2.590433 -0.386576
H 1.086452 1.177103 -2.685458
H 3.862315 2.557945 0.345370
H -0.135255 -0.069404 -0.816754
H 3.341491 2.156028 -2.104050
H 2.050165 3.104054 -1.326894
H 4.733986 0.599050 -0.736527
H 2.308794 1.625444 2.097984
H 1.592863 2.903111 1.086894
H 1.673029 -1.198147 -2.020881
H 3.059435 -0.247181 -2.646033
H -0.202925 3.020318 -0.764052
H -1.102429 1.955790 -1.878565
H 3.822036 0.201227 2.167309
H 5.395281 0.738904 1.527749
H 0.258969 0.723465 2.746725
H -0.671021 -0.254792 1.580163
H -2.534516 2.742531 0.076933
H -2.092856 1.660343 2.320273
H -0.821333 2.827057 1.878126
H 5.517268 -1.660472 2.307470
H 5.714819 -1.610694 0.537931
H 3.100669 -2.224524 2.087211
H 4.004381 -3.375369 1.085285
H -2.662848 -1.653776 -0.833923
H -6.585392 -0.671330 0.475047
H -4.019588 -3.808494 -1.224484
H -6.589034 -3.276228 -0.407131


