%chk=000164157.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000164157

0 1
 O   -2.019400       1.415700      -1.130100    
 N    2.952700      0.4330000     -0.9392000    
 N    3.133600     -0.5440000       1.193900    
 N    1.859300      -2.509900       1.757900    
 C    2.646800       2.848000     -0.8851000    
 C    3.539700       1.663300     -0.5192000    
 C    1.264400       2.754700     -0.2867000    
 C    2.568200     -0.5816000     -2.7400000E-02
 C    1.646400      -1.545100     -0.4274000    
 C   0.2573000       2.120400     -0.9970000    
 C    1.026500       3.306700      0.9622000    
 C   -1.020500       2.035600     -0.4440000    
 C    1.313400      -2.518000      0.5292000    
 C  -0.2515000       3.222100       1.514900    
 C   -1.274900       2.586500      0.8119000    
 C    1.069300      -1.563500      -1.709000    
 C   0.3941000      -3.499100      0.1656000    
 C   0.1534000      -2.555400      -2.045400    
 C  -0.1844000      -3.524100      -1.107000    
 C    2.739600      -1.523400       2.023500    
 C   -2.830300      0.5366000     -0.4321000    
 C   -2.249500     -0.3780000      0.4275000    
 C   -4.200100      0.5952000     -0.6140000    
 C   -3.066600      -1.264300       1.129400    
 C   -5.017200     -0.2909000      8.8000000E-02
 C   -4.450500      -1.220500      0.9598000    
 H    2.560100       2.923300      -1.977600    
 H    3.126900       3.781300     -0.5644000    
 H    3.751700       1.694100      0.5561000    
 H    4.506500       1.783900      -1.022000    
 H    3.028800      0.1803000      -1.917500    
 H   0.4475000       1.696000      -1.978900    
 H    1.817400       3.802300       1.517700    
 H  -0.4504000       3.655200       2.490900    
 H   -2.265800       2.556300       1.257300    
 H    1.302400     -0.8193000      -2.464600    
 H   0.1116000      -4.267900      0.8822000    
 H  -0.2971000      -2.571300      -3.033000    
 H  -0.8999000      -4.300800      -1.360700    
 H    3.175300      -1.522100       3.015200    
 H   -1.175100     -0.4422000      0.5651000    
 H   -4.642600       1.318400      -1.292400    
 H   -2.624800      -1.991100       1.804900    
 H   -6.094600     -0.2571000     -4.4500001E-02
 H   -5.086500      -1.911300       1.505600    


%chk=000164157-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000164157

0 1
O -2.071117 1.628244 -0.743502
N 2.972287 0.388508 -1.067522
N 2.394673 -0.185141 1.134631
N 0.964698 -2.093751 1.673788
C 2.713068 2.903621 -1.007401
C 3.590245 1.658594 -0.660635
C 1.388040 2.906169 -0.262908
C 2.336899 -0.468777 -0.194429
C 1.623017 -1.645882 -0.685533
C 0.246095 2.286622 -0.826023
C 1.293151 3.458420 1.040057
C -0.950015 2.200611 -0.085005
C 0.927413 -2.421939 0.314105
C 0.085117 3.380260 1.767719
C -1.048721 2.746047 1.214603
C 1.560932 -2.053962 -2.051735
C 0.176949 -3.567757 -0.090648
C 0.823614 -3.185262 -2.424211
C 0.124459 -3.942797 -1.436745
C 1.710335 -1.018131 1.988664
C -2.859864 0.651247 -0.079320
C -2.330185 -0.236441 0.886272
C -4.202931 0.550547 -0.505460
C -3.170421 -1.232014 1.432791
C -5.029285 -0.450544 0.049776
C -4.519630 -1.343701 1.022709
H 2.545322 2.933812 -2.102103
H 3.305484 3.802131 -0.746887
H 3.747526 1.599930 0.428175
H 4.574458 1.756172 -1.158118
H 2.890127 0.201615 -2.066355
H 0.271071 1.855369 -1.832324
H 2.169932 3.939717 1.489335
H 0.021571 3.815731 2.771027
H -1.989457 2.681059 1.770334
H 2.094001 -1.497378 -2.833024
H -0.343674 -4.131995 0.689014
H 0.781132 -3.490171 -3.475305
H -0.454431 -4.822358 -1.738722
H 1.781271 -0.758425 3.050346
H -1.284619 -0.167255 1.201024
H -4.574796 1.250448 -1.259916
H -2.756323 -1.924542 2.173950
H -6.072208 -0.530340 -0.276849
H -5.164010 -2.118309 1.451961


