%chk=000030937.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000030937

0 1
 N   -2.388500     -0.4122000     -0.3012000    
 N    5.742700      -3.646600      0.7588000    
 N    2.448400       5.150000      0.7207000    
 C    1.426500     -0.2542000     -0.7432000    
 C   4.0199999E-02 -0.7626000     -0.2674000    
 C   -1.113400      0.1008000     -0.7906000    
 C    2.581900      -1.162300     -0.3413000    
 C    1.700500       1.194700     -0.3509000    
 C    3.652100      -1.297300      -1.200700    
 C    1.809800       2.141500      -1.345900    
 C    2.521100      -1.820100      0.8691000    
 C    1.829200       1.506700      0.9850000    
 C   -3.491600      0.4220000     -0.7555000    
 C    4.709900      -2.128500     -0.8326000    
 C    2.060100       3.466100     -0.9872000    
 C    3.578900      -2.651400       1.237200    
 C    2.079600       2.831200       1.343700    
 C    4.673300      -2.805700      0.3863000    
 C    2.195100       3.810900      0.3576000    
 C   -4.802100     -0.1171000     -0.2530000    
 C   -5.502300      -1.040300      -1.018900    
 C   -5.297000      0.3145000      0.9709000    
 C   -6.718100      -1.540500     -0.5529000    
 C   -6.512800     -0.1859000       1.436800    
 C   -7.223400      -1.113400      0.6750000    
 H    1.375000     -0.3031000      -1.842100    
 H  -0.1009000      -1.800800     -0.5975000    
 H  -2.2700001E-02 -0.7659000      0.8277000    
 H   -1.101200      9.1600001E-02  -1.887000    
 H  -0.9908000       1.137500     -0.4583000    
 H   -2.372600     -0.4340000      0.7186000    
 H    3.690200     -0.7730000      -2.150700    
 H    1.705900       1.884800      -2.395500    
 H    1.696700      -1.718000       1.564600    
 H    1.730400      0.7650000       1.770000    
 H   -3.516700      0.4642000      -1.852100    
 H   -3.368100       1.456600     -0.4093000    
 H    5.557400      -2.240100      -1.504000    
 H    2.147900       4.220500      -1.764900    
 H    3.540400      -3.171600       2.191000    
 H    2.179900       3.087900       2.395300    
 H   -5.117500      -1.381300      -1.976000    
 H   -4.751100       1.035300       1.573200    
 H    5.716700      -4.137100       1.642800    
 H    6.536900      -3.758400      0.1428000    
 H    2.545600       5.400400       1.695700    
 H    2.531700       5.861000      6.3999998E-03
 H   -7.271100      -2.263100      -1.145900    
 H   -6.906100      0.1463000       2.393200    
 H   -8.170000      -1.503200       1.038000    


%chk=000030937-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000030937

0 1
N -2.427033 -0.263035 -0.245737
N 5.783423 -3.838950 0.530125
N 2.639455 5.201179 0.919812
C 1.418269 -0.220955 -0.782493
C 0.023184 -0.661269 -0.253802
C -1.133777 0.188800 -0.809184
C 2.540680 -1.207421 -0.412115
C 1.762246 1.211222 -0.341388
C 3.827494 -1.039920 -0.990780
C 1.715909 2.296507 -1.250550
C 2.376956 -2.283136 0.495584
C 2.117468 1.498187 1.002406
C -3.603360 0.484108 -0.740212
C 4.898631 -1.899905 -0.690885
C 2.004708 3.617252 -0.847510
C 3.441076 -3.154040 0.814545
C 2.403546 2.809384 1.425962
C 4.722878 -2.979154 0.224241
C 2.351601 3.896499 0.504461
C -4.913601 -0.086832 -0.207733
C -5.079003 -1.486537 -0.045888
C -5.996998 0.770432 0.108564
C -6.305233 -2.015698 0.414249
C -7.227306 0.242852 0.564266
C -7.385699 -1.153742 0.718497
H 1.346127 -0.205769 -1.891838
H -0.164821 -1.717858 -0.523665
H 0.017527 -0.601284 0.855224
H -1.182891 0.067099 -1.911266
H -0.932297 1.269556 -0.613619
H -2.402084 -0.276385 0.784412
H 3.993045 -0.206013 -1.684813
H 1.449461 2.106929 -2.298871
H 1.405410 -2.461098 0.968521
H 2.189892 0.675131 1.724236
H -3.591965 0.407379 -1.848178
H -3.560898 1.578457 -0.508804
H 5.877951 -1.740668 -1.160146
H 1.963590 4.435323 -1.577923
H 3.278078 -3.977790 1.521355
H 2.679262 2.999862 2.471233
H -4.231599 -2.139985 -0.279306
H -5.877106 1.855964 -0.000987
H 5.658056 -4.609982 1.178596
H 6.697465 -3.707280 0.108404
H 2.897880 5.395089 1.882286
H 2.613702 5.974419 0.262461
H -6.420198 -3.099375 0.534643
H -8.056010 0.919102 0.804243
H -8.337091 -1.564853 1.075168


