%chk=000027323.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000027323

0 1
 O   0.6899000      -1.061800      3.6600001E-02
 N    4.361100      -1.142600      0.2096000    
 C  -0.2721000     -0.3406000     -0.7368000    
 C  -9.8600000E-02   1.143200     -0.4929000    
 C   -1.681200     -0.8348000     -0.4736000    
 C  -0.3541000       1.733500      0.7612000    
 C   -2.300800     -0.7008000      0.7850000    
 C    2.013100     -0.6946000     -0.3178000    
 C    2.986100      -1.475200      0.5513000    
 C   0.3511000       1.954100      -1.551000    
 C   -2.382500      -1.464500      -1.517800    
 C  -0.8082000      0.9714000       1.935000    
 C   -1.646000     -7.6499999E-02   1.945200    
 C  -0.1267000       3.110000      0.9307000    
 C   -3.591500      -1.224200      0.9732000    
 C   0.5556000       3.321300      -1.371000    
 C   -3.669100      -1.963400      -1.319500    
 C   0.3198000       3.898700     -0.1293000    
 C   -4.272400      -1.846200     -7.3100001E-02
 C    4.627000      -1.425600      -1.203000    
 C    5.299400      -1.881300       1.058100    
 H  -4.9899999E-02 -0.5511000      -1.792400    
 H    2.140100     -0.9266000      -1.379500    
 H    2.203600      0.3708000     -0.1542000    
 H    2.785100      -1.230100       1.602500    
 H    2.788400      -2.551100      0.4492000    
 H   0.5529000       1.521400      -2.528300    
 H   -1.926500      -1.577600      -2.498800    
 H  -0.4398000       1.331000       2.894200    
 H   -1.906700     -0.5033000       2.912200    
 H  -0.3034000       3.586000       1.893400    
 H   -4.085500      -1.145500       1.939800    
 H   0.9046000       3.932000      -2.198400    
 H   -4.195900      -2.448000      -2.136200    
 H   0.4840000       4.962200      1.6700000E-02
 H   -5.272100      -2.239100      8.7099999E-02
 H    4.318000      -2.436100      -1.494200    
 H    5.699700      -1.334200      -1.414200    
 H    4.151000     -0.6937000      -1.862700    
 H    5.216100      -2.965400      0.9198000    
 H    5.122500      -1.653300       2.115200    
 H    6.331500      -1.582900      0.8428000    


%chk=000027323-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000027323

0 1
O 0.647986 -0.945364 -0.044263
N 4.349716 -1.374731 0.233452
C -0.352470 -0.159268 -0.815186
C -0.219712 1.338761 -0.569724
C -1.702576 -0.760775 -0.477019
C -0.383302 1.918464 0.730688
C -2.246683 -0.705231 0.846320
C 2.041714 -0.605772 -0.376255
C 2.902904 -1.692040 0.285315
C 0.185569 2.162945 -1.647882
C -2.392169 -1.480849 -1.481302
C -0.884297 1.194667 1.903145
C -1.679453 0.075603 1.950537
C -0.068893 3.301057 0.898671
C -3.443384 -1.436433 1.114736
C 0.453485 3.536873 -1.472322
C -3.594482 -2.166082 -1.207295
C 0.338455 4.105558 -0.181274
C -4.115816 -2.152854 0.108337
C 4.911871 -1.437849 -1.131052
C 5.128044 -2.195962 1.182906
H -0.155070 -0.332953 -1.897474
H 2.166176 -0.589313 -1.482127
H 2.319512 0.389184 0.024421
H 2.597257 -1.749167 1.346101
H 2.665356 -2.682521 -0.179603
H 0.309702 1.711103 -2.640221
H -1.963150 -1.523403 -2.489828
H -0.666870 1.677238 2.866778
H -2.023110 -0.231907 2.948632
H -0.175461 3.745234 1.895961
H -3.854919 -1.413720 2.131256
H 0.768641 4.151185 -2.322760
H -4.105834 -2.721625 -2.000822
H 0.562791 5.166066 -0.022571
H -5.038096 -2.695714 0.342733
H 4.822710 -2.453654 -1.597274
H 5.983082 -1.169765 -1.099352
H 4.405610 -0.712927 -1.791304
H 5.108147 -3.291296 0.947262
H 4.731374 -2.059695 2.204561
H 6.183250 -1.867566 1.179195


