%chk=000132436.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000132436

0 1
 O  -0.2970000     -0.8420000       1.226400    
 O    1.626800      -2.118400     -3.6699999E-02
 O   -3.969200      0.4761000      0.7266000    
 N   0.4048000       1.185700      0.3012000    
 N    2.802800     -0.1191000     -0.3206000    
 N   -2.207800      0.6149000     -0.7748000    
 N   -3.445100      -1.304600     -0.6681000    
 C    1.412300       1.859800     -0.5002000    
 C    2.783600       1.324100     -0.1523000    
 C  -0.7709000       1.948400      0.6872000    
 C   0.5026000     -0.1702000      0.5846000    
 C    1.709800     -0.8975000      3.6899999E-02
 C    4.048700     -0.7308000     -0.7524000    
 C   -1.803500       1.971900     -0.4302000    
 C    4.952900     -0.9725000      0.4409000    
 C   -3.271500     -2.1600001E-02 -0.1561000    
 C   -4.479400      -2.204400     -0.2123000    
 H    1.377900       2.938400     -0.3150000    
 H    1.172200       1.676900      -1.553900    
 H    3.536700       1.786700     -0.7986000    
 H    3.038200       1.538200      0.8921000    
 H   -1.208300       1.488000       1.581100    
 H  -0.4682000       2.965000      0.9603000    
 H    3.827100      -1.690800      -1.232000    
 H    4.533900     -9.2000000E-02  -1.497400    
 H   -2.683400       2.545700     -0.1216000    
 H   -1.394200       2.425000      -1.338900    
 H    5.883200      -1.452000      0.1213000    
 H    5.209700     -3.2499999E-02  0.9406000    
 H    4.470900      -1.622000       1.179400    
 H   -1.681500      0.1203000      -1.488400    
 H   -2.840600      -1.613600      -1.422800    
 H   -5.315100      -2.148300     -0.9142000    
 H   -4.820500      -1.931400      0.7892000    
 H   -4.074700      -3.219100     -0.2059000    


%chk=000132436-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000132436

0 1
O -0.024093 -1.273773 0.166002
O 2.423377 -2.026366 -1.013749
O -4.635773 0.944837 -0.335426
N 0.666202 0.950412 0.153729
N 3.301648 0.073609 -0.485750
N -2.485252 0.009519 -0.339370
N -4.366296 -1.383908 -0.228327
C 1.707739 1.931951 -0.230764
C 3.092096 1.392686 0.143403
C -0.663576 1.433190 0.626943
C 0.875513 -0.403608 -0.045031
C 2.270217 -0.858067 -0.559815
C 4.679688 -0.335544 -0.846607
C -1.821317 1.309662 -0.400372
C 5.549974 -0.657999 0.387733
C -3.875247 -0.078962 -0.304339
C -5.802897 -1.656325 -0.177265
H 1.520120 2.873661 0.313289
H 1.662947 2.147809 -1.317779
H 3.869695 2.084401 -0.228173
H 3.189455 1.330440 1.247086
H -0.940357 0.869821 1.537176
H -0.530553 2.494318 0.901533
H 4.586815 -1.228360 -1.486620
H 5.136931 0.477278 -1.443336
H -2.598089 2.066802 -0.185271
H -1.427897 1.525156 -1.416989
H 6.564129 -0.955626 0.065824
H 5.651575 0.214399 1.059037
H 5.112128 -1.493231 0.960665
H -1.869982 -0.804021 -0.208983
H -3.712353 -2.167033 -0.238729
H -6.138973 -2.249798 -1.049493
H -6.318825 -0.682518 -0.193904
H -6.085569 -2.192512 0.749069


