%chk=000027269.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000027269

0 1
 O    6.166100     -0.2198000     -0.6166000    
 N   -1.488600      0.1207000      0.5417000    
 N   -3.372800       3.293800     -2.0099999E-02
 N   0.1848000      -1.258100      5.2900001E-02
 N   -3.057000      -6.307200     -0.3830000    
 C   -2.182700       1.347200      0.8633000    
 C   -2.657300       2.078700     -0.3889000    
 C  -0.1459000     -1.5300000E-02  0.3236000    
 C   -2.062700      -1.116800      0.4029000    
 C  -0.9978000      -1.960100      9.8099999E-02
 C   0.7829000       1.131500      0.3967000    
 C   -2.523400       4.166200      0.7930000    
 C   -3.833000       4.004300      -1.214700    
 C   -3.381900      -1.557600      0.5143000    
 C    2.235900      0.7672000      0.1231000    
 C   -1.245000      -3.327500     -0.1107000    
 C   -3.278800       5.406300       1.240100    
 C   -4.717300       3.117200      -2.074600    
 C   -3.609800      -2.921500      0.3030000    
 C   -2.561800      -3.792500     -4.0000002E-03
 C    2.702900      0.8193000      -1.173500    
 C    3.039300      0.3956000       1.181100    
 C    4.033800      0.4847000      -1.423800    
 C    4.370200      6.1099999E-02  0.9308000    
 C    4.867500      0.1056000     -0.3716000    
 C   -2.835300      -5.180600     -0.2132000    
 C    7.107500      3.7999999E-02  0.4240000    
 C    8.460400      0.3199000     -0.1939000    
 H   -3.028200       1.093900       1.514400    
 H   -1.483500       1.921600       1.473300    
 H   -1.807600       2.299200      -1.048200    
 H   -3.309600       1.383300     -0.9282000    
 H   0.4795000       1.911000     -0.3137000    
 H   0.7311000       1.595700       1.390100    
 H   -1.604200       4.454800      0.2681000    
 H   -2.236400       3.686100       1.731400    
 H   -4.454900       4.861700     -0.9377000    
 H   -2.995600       4.381500      -1.815300    
 H   -4.198800     -0.8849000      0.7494000    
 H  -0.4259000      -3.999900     -0.3493000    
 H   -3.410800       6.130500      0.4303000    
 H   -4.260000       5.156400       1.658300    
 H   -2.711400       5.919300       2.025200    
 H   -5.233100       3.730300      -2.822500    
 H   -5.487800       2.612200      -1.481700    
 H   -4.145200       2.367900      -2.630600    
 H   -4.629400      -3.294700      0.3824000    
 H    2.059400       1.111600      -1.997800    
 H    2.656800      0.3507000       2.196300    
 H    4.415500      0.5210000      -2.440500    
 H    4.977300     -0.2555000       1.773700    
 H    6.828300      0.9168000       1.018700    
 H    7.173300     -0.8403000       1.075500    
 H    9.211200      0.5121000      0.5779000    
 H    8.790100     -0.5281000     -0.8033000    
 H    8.407400       1.188000     -0.8593000    


%chk=000027269-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000027269

0 1
O 4.621938 2.299350 -0.380021
N -1.546068 -0.335425 1.380896
N -1.496793 2.721166 -0.888151
N -0.634567 -2.201362 2.360059
N -4.525030 -6.292792 0.009366
C -1.738172 1.061056 0.948554
C -1.228301 1.320435 -0.495617
C -0.547162 -0.862866 2.230631
C -2.318949 -1.418553 0.945143
C -1.739143 -2.578709 1.565845
C 0.488736 -0.022656 2.925368
C -0.365153 3.642578 -0.591122
C -2.045823 2.872598 -2.261183
C -3.452496 -1.500025 0.107827
C 1.558183 0.575704 2.006922
C -2.290010 -3.853976 1.341110
C -0.820291 5.090118 -0.325313
C -3.509517 2.406830 -2.378292
C -3.998569 -2.776888 -0.109639
C -3.425976 -3.946267 0.495070
C 2.001478 1.912145 2.184826
C 2.167293 -0.201434 0.993305
C 3.019157 2.456765 1.378727
C 3.188629 0.327602 0.172908
C 3.618237 1.665651 0.366426
C -4.023704 -5.229312 0.232943
C 5.306612 1.511695 -1.426106
C 6.355424 2.426837 -2.051705
H -2.812997 1.312348 0.995193
H -1.212499 1.726040 1.653356
H -0.146780 1.062839 -0.550491
H -1.754847 0.634638 -1.183780
H 0.001650 0.788677 3.500736
H 0.961588 -0.694532 3.664836
H 0.392848 3.628272 -1.413610
H 0.154998 3.261428 0.306853
H -1.999036 3.945403 -2.521786
H -1.417064 2.336270 -3.015893
H -3.903259 -0.615997 -0.354568
H -1.857065 -4.742789 1.807639
H -1.328694 5.531868 -1.201562
H -1.524636 5.119534 0.524464
H 0.050745 5.729302 -0.088578
H -3.883844 2.563261 -3.407014
H -4.147127 2.974830 -1.678586
H -3.619626 1.330328 -2.147981
H -4.878236 -2.893619 -0.749946
H 1.553733 2.532850 2.971363
H 1.846057 -1.239827 0.847482
H 3.368400 3.484809 1.516070
H 3.638721 -0.305337 -0.597438
H 5.775045 0.617607 -0.965607
H 4.564297 1.174659 -2.178843
H 6.904272 1.888142 -2.845397
H 5.880515 3.317524 -2.497161
H 7.080577 2.763707 -1.291629


