%chk=000025249.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000025249

0 1
 O   -5.444300      -1.260900      0.3738000    
 N    5.560800      0.2662000     -0.1731000    
 N    6.006400     -0.9962000     -0.3226000    
 C   -2.415500      0.6952000     -0.3134000    
 C  -0.9948000      0.9455000      0.2126000    
 C   -3.059200     -0.5853000      0.2612000    
 C  -9.6799999E-02 -0.2763000     -0.1584000    
 C    1.393400     -8.5400000E-02  0.3108000    
 C   -4.490800     -0.4878000     -0.3516000    
 C   -2.194800      -1.780100     -0.1745000    
 C  -0.7314000      -1.623500      0.2782000    
 C    1.921900       1.279200     -0.2939000    
 C   -3.477300       1.764700     -7.7200003E-02
 C  -0.4137000       2.247100     -0.3574000    
 C   -4.817800       1.026400     -0.2481000    
 C    1.031900       2.472600      7.1999997E-02
 C    2.277200      -1.267000     -0.2388000    
 C   -3.151600     -0.5814000       1.815600    
 C    1.495000     -8.5299999E-02   1.859000    
 C    3.403000       1.586200      5.5199999E-02
 C   -4.612200     -0.9594000      -1.806200    
 C    3.725100     -0.9285000     -0.2387000    
 C    4.204100      0.3541000     -0.1223000    
 C    4.881400      -1.720100     -0.3621000    
 H   -2.322400      0.5882000      -1.404800    
 H   -1.032900       1.058800       1.300800    
 H  -6.9300003E-02 -0.3122000      -1.259400    
 H   -2.190900      -1.878300      -1.266500    
 H   -2.605000      -2.716900      0.2212000    
 H  -0.6769000      -1.743300       1.363800    
 H  -0.1617000      -2.457100     -0.1481000    
 H    1.876500       1.173200      -1.389900    
 H   -3.388600       2.591800     -0.7892000    
 H   -3.402800       2.188600      0.9306000    
 H   -1.014500       3.103500     -2.9600000E-02
 H  -0.4638000       2.228800      -1.453700    
 H   -5.474000       1.237100      0.6045000    
 H   -5.340100       1.389100      -1.140900    
 H    1.408200       3.378000     -0.4199000    
 H    1.071400       2.667700       1.149900    
 H    1.988100      -1.492700      -1.273500    
 H    2.113500      -2.178100      0.3488000    
 H   -2.182900     -0.4613000       2.306200    
 H   -3.796300      0.2193000       2.191700    
 H   -3.572300      -1.527500       2.176200    
 H    2.520500      7.7500001E-02   2.204800    
 H   0.8786000      0.6912000       2.318900    
 H    1.180600      -1.045100       2.280900    
 H    3.492500       1.938100       1.089500    
 H    3.778700       2.384300     -0.5957000    
 H   -5.637100     -0.8133000      -2.168900    
 H   -3.940100     -0.4285000      -2.485600    
 H   -4.418800      -2.034500      -1.891900    
 H   -5.149100      -2.187400      0.3582000    
 H    4.955900      -2.791600     -0.4805000    
 H    6.241600       1.013300     -0.1114000    


%chk=000025249-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000025249

0 1
O -5.530651 -1.240250 0.454566
N 5.634320 0.241040 -0.114063
N 6.070212 -1.076338 -0.250966
C -2.426749 0.712932 -0.290976
C -0.990286 0.972250 0.211592
C -3.056695 -0.607144 0.254359
C -0.081889 -0.243939 -0.168974
C 1.412468 -0.060724 0.302504
C -4.517003 -0.509844 -0.348692
C -2.171842 -1.786064 -0.216076
C -0.704329 -1.606107 0.258667
C 1.948812 1.287848 -0.319394
C -3.519060 1.782163 -0.025634
C -0.414342 2.277164 -0.387537
C -4.867383 1.009666 -0.208626
C 1.053866 2.501458 0.024583
C 2.270878 -1.247642 -0.263890
C -3.167680 -0.611589 1.804959
C 1.539992 -0.047559 1.850466
C 3.427358 1.597112 0.059231
C -4.635466 -0.995283 -1.810240
C 3.749479 -0.947862 -0.223407
C 4.253758 0.355370 -0.095547
C 4.901908 -1.789828 -0.316356
H -2.344319 0.593777 -1.396190
H -1.013365 1.080944 1.316209
H -0.048736 -0.252222 -1.286062
H -2.178576 -1.842704 -1.323372
H -2.561392 -2.755165 0.161169
H -0.661052 -1.714240 1.358420
H -0.100037 -2.433248 -0.158879
H 1.914499 1.149571 -1.423347
H -3.437952 2.643840 -0.711474
H -3.427106 2.178043 1.004085
H -1.031809 3.141072 -0.074153
H -0.482196 2.221733 -1.495603
H -5.536789 1.131335 0.660174
H -5.422360 1.360098 -1.097087
H 1.455812 3.403629 -0.480301
H 1.107156 2.706349 1.113523
H 1.953792 -1.451344 -1.309253
H 2.056268 -2.169635 0.309816
H -2.187565 -0.464620 2.288635
H -3.849750 0.174487 2.169313
H -3.578704 -1.574483 2.156137
H 2.600661 -0.008542 2.156399
H 1.021219 0.812449 2.309394
H 1.114388 -0.967182 2.290543
H 3.470758 1.972985 1.103294
H 3.798845 2.420100 -0.584364
H -5.667344 -0.820755 -2.163277
H -3.946615 -0.456158 -2.485274
H -4.420899 -2.077470 -1.904271
H -5.396709 -2.213803 0.318836
H 4.953991 -2.872292 -0.426379
H 6.332807 0.977319 -0.040606


