%chk=000046662.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000046662

0 1
 N   -4.362800      0.4449000      1.4400000E-02
 N   0.3748000       1.238200      7.5300001E-02
 N    5.670900     -0.5085000     -1.5699999E-02
 C  -0.4321000      -1.024300     -6.3000001E-02
 C  -0.6468000      0.3619000      1.9900000E-02
 C    1.954800     -0.5733000     -2.9400000E-02
 C   -3.045600     -5.8600001E-02 -1.1700000E-02
 C    1.646600      0.7953000      5.1899999E-02
 C   0.8903000      -1.478700     -8.6499996E-02
 C   -1.961100      0.8205000      4.4100001E-02
 C   -1.520800      -1.911700     -0.1193000    
 C   -2.825300      -1.427500     -9.3699999E-02
 C    3.293400      -1.002100     -5.1399998E-02
 C    2.702100       1.701600      0.1090000    
 C    4.330200     -7.5499997E-02  6.6999998E-03
 C    4.033500       1.279100      8.7200001E-02
 C   -5.437800     -0.3321000      0.5862000    
 C   -4.664200       1.750800     -0.5240000    
 H    1.092900      -2.547200     -0.1502000    
 H   -2.124100       1.894200      0.1211000    
 H   -1.357300      -2.985100     -0.1861000    
 H   -3.642000      -2.140900     -0.1508000    
 H    3.522300      -2.064600     -0.1145000    
 H    2.495200       2.768500      0.1724000    
 H    4.826800       2.020900      0.1338000    
 H   -5.128300     -0.8239000       1.515400    
 H   -5.786700      -1.092500     -0.1205000    
 H   -6.296800      0.3001000      0.8387000    
 H   -4.130100       1.932300      -1.463700    
 H   -4.403300       2.536800      0.1926000    
 H   -5.732200       1.852500     -0.7481000    
 H    6.422100      0.1672000      2.6100000E-02
 H    5.883600      -1.495400     -7.4900001E-02


%chk=000046662-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000046662

0 1
N -4.421241 0.462815 -0.000249
N 0.378443 1.260909 -0.075161
N 5.754104 -0.465164 -0.025717
C -0.418098 -1.087197 0.059675
C -0.655230 0.353899 -0.017629
C 1.998219 -0.640770 0.015543
C -3.106005 -0.016717 0.019365
C 1.660856 0.781121 -0.059287
C 0.914115 -1.556122 0.074815
C -1.995285 0.851976 -0.035220
C -1.565175 -1.952876 0.116231
C -2.856346 -1.447358 0.097168
C 3.372229 -1.046398 0.026018
C 2.745543 1.727025 -0.119792
C 4.405329 -0.099066 -0.034441
C 4.067426 1.307519 -0.108214
C -5.562377 -0.458340 0.069285
C -4.653901 1.909665 -0.069362
H 1.111019 -2.634631 0.132479
H -2.104980 1.937023 -0.092933
H -1.407410 -3.037189 0.175272
H -3.699340 -2.142896 0.141723
H 3.609092 -2.117033 0.082750
H 2.482347 2.787911 -0.175532
H 4.879546 2.044547 -0.155296
H -5.567852 -1.048652 1.008666
H -5.576453 -1.168939 -0.782122
H -6.497890 0.122002 0.033921
H -4.212366 2.349700 -0.986863
H -4.212754 2.437155 0.801442
H -5.736703 2.111238 -0.080287
H 6.484034 0.239033 -0.070639
H 6.029302 -1.441290 0.025692


