%chk=000018715.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000018715

0 1
 N   -3.269900       1.025800      0.3908000    
 N    2.327300     -0.2809000      -1.613300    
 C   0.9254000      0.1931000       1.152700    
 C  -0.4185000      0.9256000       1.004600    
 C   -2.801000       1.057400       1.775900    
 C   -1.477800      0.3047000       1.905400    
 C   -3.508100     -0.3591000     -3.9700001E-02
 C   -4.480700       1.844900      0.2391000    
 C   -3.952300     -0.4136000      -1.502200    
 C   -4.956700       1.862600      -1.214300    
 C   -5.186000      0.4501000      -1.739800    
 C   0.7899000      -1.281600      0.8141000    
 C    2.076600      0.9846000      0.5175000    
 C   0.7600000      -1.746800     -0.5085000    
 C    2.702400      0.7345000     -0.7335000    
 C   0.9654000     -0.7908000      -1.644200    
 C   0.6310000      -2.211800       1.858700    
 C    2.539600       2.067600       1.314200    
 C   0.5895000      -3.116700     -0.7662000    
 C    3.782500       1.587200      -1.087200    
 C    3.244200     -0.7640000      -2.641900    
 C   0.4600000      -3.570900       1.594300    
 C    3.595600       2.882900      0.9241000    
 C   0.4389000      -4.023600      0.2806000    
 C    4.222400       2.638600     -0.2810000    
 H    1.166200      0.2038000       2.228000    
 H  -0.3009000       1.982500       1.278400    
 H  -0.7430000      0.9248000     -3.9000001E-02
 H   -3.540000      0.6201000       2.459500    
 H   -2.645100       2.096200       2.093700    
 H   -1.623700     -0.7641000       1.742100    
 H   -1.148400      0.3950000       2.949400    
 H   -4.262200     -0.8440000      0.5940000    
 H   -2.600500     -0.9671000      3.3000000E-03
 H   -4.270500       2.878200      0.5407000    
 H   -5.286900       1.473800      0.8858000    
 H   -4.167900      -1.450000      -1.786100    
 H   -3.134500     -6.8499997E-02  -2.147900    
 H   -4.209500       2.368200      -1.839300    
 H   -5.883800       2.441400      -1.293400    
 H   -5.424300      0.4801000      -2.808600    
 H   -6.048400      4.9000001E-03  -1.228800    
 H   0.7724000      -1.302300      -2.596600    
 H   0.2350000      2.3300000E-02  -1.633000    
 H   0.6363000      -1.882400       2.895400    
 H    2.066000       2.277900       2.272500    
 H   0.5788000      -3.486800      -1.788500    
 H    4.303600       1.459600      -2.034500    
 H    2.923600      -1.736400      -3.032700    
 H    4.253300     -0.9121000      -2.240800    
 H    3.283500     -6.6100001E-02  -3.484800    
 H   0.3409000      -4.272700       2.414300    
 H    3.923100       3.698500       1.560700    
 H   0.3074000      -5.080700      7.0100002E-02
 H    5.049000       3.263400     -0.6056000    


%chk=000018715-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000018715

0 1
N -3.362616 0.926404 0.363573
N 2.302442 -0.150072 -1.653568
C 0.982339 0.185244 1.217663
C -0.382203 0.950924 1.065280
C -2.852000 1.123635 1.745178
C -1.492635 0.435253 2.004447
C -3.790574 -0.471026 0.099128
C -4.442240 1.890215 0.029985
C -4.185764 -0.662398 -1.379834
C -4.854235 1.777587 -1.451983
C -5.293427 0.334574 -1.788567
C 0.854128 -1.291770 0.839595
C 2.155187 0.977152 0.589582
C 0.742487 -1.709971 -0.516485
C 2.755662 0.792586 -0.710288
C 0.921956 -0.673106 -1.613536
C 0.783286 -2.274984 1.856589
C 2.700695 1.981306 1.431780
C 0.545061 -3.075939 -0.823051
C 3.887134 1.602672 -1.054134
C 3.156183 -0.555040 -2.775471
C 0.590196 -3.642018 1.549113
C 3.802740 2.785504 1.077041
C 0.463104 -4.046723 0.201978
C 4.404505 2.576681 -0.182886
H 1.191294 0.196774 2.307210
H -0.190715 2.022113 1.275940
H -0.759045 0.904462 0.028279
H -3.594021 0.769442 2.508579
H -2.732174 2.214815 1.897879
H -1.595748 -0.661733 1.903988
H -1.211340 0.621939 3.061916
H -4.661963 -0.750407 0.752275
H -2.960642 -1.154520 0.351330
H -4.072947 2.911055 0.243916
H -5.348737 1.722392 0.673443
H -4.519516 -1.706225 -1.537795
H -3.289166 -0.498138 -2.009452
H -3.987973 2.057370 -2.082518
H -5.670556 2.495307 -1.663028
H -5.525092 0.239539 -2.866559
H -6.225507 0.095400 -1.234959
H 0.693853 -1.116848 -2.598252
H 0.219059 0.170813 -1.477999
H 0.879462 -1.965172 2.904707
H 2.247856 2.114460 2.423710
H 0.458342 -3.383175 -1.873213
H 4.348092 1.485324 -2.039071
H 2.794466 -1.517194 -3.176908
H 4.198934 -0.707381 -2.440581
H 3.166700 0.181636 -3.609590
H 0.538645 -4.382492 2.355309
H 4.188843 3.539357 1.770776
H 0.308979 -5.102593 -0.047303
H 5.268405 3.175290 -0.494659


