%chk=000014154.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000014154

0 1
 O    6.265300     -0.9989000     -2.2800000E-02
 O  -0.4695000       1.877900      6.0100000E-02
 N    3.719600      0.2588000      0.1749000    
 N   -1.831900       1.724000      0.2854000    
 C    4.033100     -0.6739000     -0.9166000    
 C    4.502700     -8.3400004E-02   1.370300    
 C    2.288600      0.2483000      0.4715000    
 C    5.532500     -0.6550000      -1.199500    
 C    5.991000     -7.7299997E-02   1.033100    
 C    1.473200      0.7081000     -0.7387000    
 C  -4.3000001E-03  0.7220000     -0.4332000    
 C  -0.9655000     -0.2066000     -0.5567000    
 C   -2.105200      0.4713000     -9.0400003E-02
 C   -3.443100     -4.8900001E-02  3.3000000E-03
 C   -3.645400      -1.409600      0.2261000    
 C   -4.533000      0.8094000     -0.1291000    
 C   -4.942700      -1.914100      0.3165000    
 C   -5.830300      0.3047000     -3.8500000E-02
 C   -6.035000      -1.057000      0.1843000    
 H    3.545300     -0.3947000      -1.853900    
 H    3.722000      -1.693000     -0.6526000    
 H    4.216900      -1.076500       1.740900    
 H    4.316900      0.6440000       2.168700    
 H    1.957700     -0.7488000      0.7930000    
 H    2.084600      0.9314000       1.306800    
 H    5.776400      -1.393800      -1.969800    
 H    5.864200      0.3251000      -1.563500    
 H    6.336800      0.9230000      0.7453000    
 H    6.572200     -0.3899000       1.906600    
 H    1.595600      4.1999999E-02  -1.598700    
 H    1.787900       1.710400      -1.055400    
 H  -0.8685000      -1.215900     -0.9291000    
 H   -2.814700      -2.100800      0.3433000    
 H   -4.405500       1.873600     -0.3118000    
 H   -5.102600      -2.973900      0.4922000    
 H   -6.681300      0.9714000     -0.1433000    
 H   -7.045100      -1.449800      0.2549000    


%chk=000014154-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000014154

0 1
O 6.619443 -0.649783 0.149889
O -0.347641 1.479309 0.389209
N 3.827108 0.171005 0.088323
N -1.787786 1.409093 0.638980
C 4.283688 -1.074853 -0.583230
C 4.698269 0.464428 1.258987
C 2.393151 0.146627 0.456628
C 5.755887 -0.936948 -1.006011
C 6.162116 0.586819 0.807080
C 1.473354 0.293873 -0.786131
C 0.024106 0.392305 -0.420885
C -1.100273 -0.363150 -0.694536
C -2.201398 0.294234 -0.026994
C -3.625757 -0.097069 0.001972
C -4.066987 -1.280243 -0.648123
C -4.578458 0.709414 0.684545
C -5.428701 -1.649980 -0.617477
C -5.936836 0.337647 0.713718
C -6.369283 -0.843308 0.063113
H 3.671516 -1.258058 -1.485510
H 4.176165 -1.961313 0.092813
H 4.624233 -0.336494 2.037086
H 4.373194 1.418011 1.716064
H 2.115181 -0.783162 1.014943
H 2.198176 1.000652 1.130093
H 6.136523 -1.880136 -1.431708
H 5.849980 -0.122084 -1.755977
H 6.263990 1.442907 0.105818
H 6.834509 0.729538 1.668950
H 1.593877 -0.565260 -1.469093
H 1.794204 1.199596 -1.334497
H -1.137399 -1.266551 -1.297146
H -3.349600 -1.916707 -1.177747
H -4.237752 1.621736 1.184378
H -5.754906 -2.565680 -1.122734
H -6.660678 0.967588 1.242281
H -7.426311 -1.130400 0.086528


