%chk=000014619.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000014619

0 1
 O   0.7695000       1.611800     -0.4891000    
 N   -3.274900      0.2473000     -3.7099998E-02
 N  -0.5683000       1.927500     -0.2851000    
 C   -4.686900      0.2348000      0.3439000    
 C   -2.900400      -1.161900     -0.1527000    
 C   -5.269200     -0.8554000     -0.5435000    
 C   -4.095800      -1.775200     -0.8670000    
 C   -2.447400      0.9654000      0.9209000    
 C   -1.007500      0.9516000      0.4883000    
 C  -5.2299999E-02  2.2000000E-03  0.8164000    
 C    1.064800      0.4634000      0.1717000    
 C    2.420000      8.9999996E-03  5.3399999E-02
 C    2.829100      -1.164500      0.6961000    
 C    3.345100      0.7351000     -0.7048000    
 C    4.147100      -1.606500      0.5824000    
 C    4.663000      0.2931000     -0.8186000    
 C    5.064100     -0.8778000     -0.1750000    
 H   -5.171400       1.200200      0.1668000    
 H   -4.821500     -3.5900000E-02   1.399100    
 H   -2.777100      -1.637400      0.8290000    
 H   -1.993100      -1.321600     -0.7433000    
 H   -5.672400     -0.4295000      -1.469800    
 H   -6.079300      -1.392900     -4.0500000E-02
 H   -4.280700      -2.800800     -0.5316000    
 H   -3.932900      -1.800200      -1.950900    
 H   -2.527700      0.5351000       1.928300    
 H   -2.787500       2.006500      0.9962000    
 H  -0.1505000     -0.8826000       1.428100    
 H    2.138200      -1.754200       1.293400    
 H    3.071400       1.652000      -1.221100    
 H    4.459800      -2.518000       1.083300    
 H    5.377600      0.8600000      -1.408200    
 H    6.090400      -1.221900     -0.2636000    


%chk=000014619-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000014619

0 1
O 0.887147 1.832359 -0.325454
N -3.305408 0.124449 -0.005949
N -0.535088 2.121267 -0.096761
C -4.767555 0.292690 0.201220
C -3.060154 -1.339028 0.067616
C -5.369357 -0.829327 -0.674040
C -4.302966 -1.975256 -0.620748
C -2.477851 0.961905 0.885303
C -1.019472 0.998997 0.490903
C -0.003361 -0.002059 0.670698
C 1.167688 0.539970 0.152350
C 2.545285 0.061335 0.021790
C 2.901402 -1.239559 0.474070
C 3.545513 0.891253 -0.557145
C 4.228005 -1.698421 0.350642
C 4.870728 0.426544 -0.678273
C 5.218930 -0.868121 -0.225806
H -5.088117 1.304607 -0.103839
H -5.057387 0.145878 1.275046
H -2.990274 -1.683931 1.133753
H -2.112818 -1.600283 -0.434921
H -5.489226 -0.469519 -1.709892
H -6.359117 -1.151938 -0.306803
H -4.663683 -2.846288 -0.046214
H -4.058997 -2.325535 -1.637631
H -2.548472 0.622026 1.952964
H -2.864667 1.995650 0.840155
H -0.133604 -0.977632 1.131566
H 2.141418 -1.890216 0.920862
H 3.272074 1.891810 -0.905955
H 4.490282 -2.702010 0.702726
H 5.632792 1.073807 -1.125680
H 6.249610 -1.226723 -0.321150


