%chk=000017843.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000017843

0 1
 N    2.555700      0.2954000      2.4599999E-02
 N   0.7499000     -0.7859000      0.8029000    
 N   0.5626000       1.329900     -0.3783000    
 C    4.782600      0.9935000     -0.2442000    
 C    4.757400     -0.5178000     -8.0300003E-02
 C    3.347400       1.317400     -0.6464000    
 C    3.394600     -0.7697000      0.5572000    
 C    1.214100      0.3297000      0.1373000    
 C  -0.3965000      -1.506500      0.4102000    
 C   -1.556900     -0.8974000     -0.1053000    
 C   -1.805400      0.5650000     -2.2299999E-02
 C  -0.8055000       1.549100     -0.1596000    
 C  -0.3003000      -2.916800      0.4379000    
 C   -2.548900      -1.749200     -0.6495000    
 C   -3.124200       1.018400      0.2419000    
 C   -1.161900       2.914400     -8.9000002E-02
 C   -1.309900      -3.727000     -7.1300000E-02
 C   -2.430700      -3.140400     -0.6328000    
 C   -3.454500       2.372100      0.3211000    
 C   -2.469600       3.325700      0.1461000    
 H    5.021700       1.468900      0.7148000    
 H    5.512300       1.330100     -0.9857000    
 H    4.809200      -1.000200      -1.064000    
 H    5.582700     -0.8943000      0.5304000    
 H    3.077100       2.330900     -0.3319000    
 H    3.220500       1.233200      -1.731500    
 H    3.053000      -1.773700      0.2819000    
 H    3.467300     -0.6883000       1.647900    
 H    1.355000      -1.296600       1.435400    
 H   0.5955000      -3.391900      0.8344000    
 H   -3.450400      -1.334400      -1.098000    
 H   -3.932600      0.3072000      0.4062000    
 H  -0.3942000       3.677700     -0.2105000    
 H   -1.207900      -4.807400     -4.9300000E-02
 H   -3.219300      -3.757900      -1.052500    
 H   -4.478700       2.671900      0.5209000    
 H   -2.709900       4.382600      0.2017000    


%chk=000017843-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000017843

0 1
N 2.629894 0.295029 0.179461
N 0.675265 -0.783884 0.958158
N 0.588686 1.294571 -0.323170
C 4.851017 1.057047 -0.163987
C 4.831356 -0.488430 -0.292208
C 3.373145 1.448285 -0.388592
C 3.500501 -0.888953 0.395143
C 1.243261 0.299969 0.234769
C -0.426223 -1.545862 0.454618
C -1.595432 -0.915115 -0.067948
C -1.831552 0.560635 -0.008814
C -0.791164 1.543964 -0.148475
C -0.330405 -2.959900 0.507681
C -2.602680 -1.767363 -0.602456
C -3.168829 1.020337 0.159894
C -1.150182 2.923436 -0.170476
C -1.373976 -3.777548 0.027521
C -2.509521 -3.173910 -0.556537
C -3.503455 2.388617 0.166241
C -2.480889 3.350045 -0.013719
H 5.176431 1.352348 0.850750
H 5.523853 1.537785 -0.893640
H 4.803171 -0.778282 -1.358448
H 5.704052 -0.975640 0.174363
H 3.071470 2.380299 0.118426
H 3.131624 1.568535 -1.462642
H 3.057842 -1.799933 -0.050552
H 3.667809 -1.077859 1.477796
H 1.305038 -1.289553 1.585007
H 0.575336 -3.417706 0.926394
H -3.480932 -1.308114 -1.068585
H -3.962282 0.281679 0.320507
H -0.337323 3.642007 -0.315769
H -1.287743 -4.867984 0.086829
H -3.313462 -3.789845 -0.972982
H -4.543732 2.699139 0.311435
H -2.718667 4.419855 -0.025594


