%chk=000021772.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000021772

0 1
 N    3.278500       1.812200      0.9693000    
 C  -0.3822000      0.1787000     -0.7871000    
 C   0.7302000       1.135200     -0.3299000    
 C    2.086400      0.8516000     -0.9972000    
 C  -3.7700001E-02  -1.274900     -0.5102000    
 C   -1.761100      0.6771000     -0.3643000    
 C  -8.5400000E-02  -1.842900      0.7727000    
 C   -2.478700      0.2959000      0.7868000    
 C    3.166100       1.826700     -0.4857000    
 C  -0.5799000      -1.057300       1.953400    
 C   -2.059600     -0.7314000       1.814700    
 C    2.005700      0.9531000      -2.524600    
 C   0.4014000      -2.076800      -1.583200    
 C   -2.340700       1.649500      -1.218500    
 C   0.2992000      -3.183500      0.9560000    
 C   -3.754100      0.8689000       1.011600    
 C   0.7778000      -3.405900      -1.390300    
 C   -3.591600       2.210500     -0.9682000    
 C   0.7282000      -3.959700     -0.1182000    
 C   -4.303600       1.815300      0.1502000    
 C    4.275400       2.785300       1.417800    
 C    3.625800      0.4724000       1.445100    
 H  -0.4324000      0.2429000      -1.882300    
 H   0.4411000       2.167800     -0.5721000    
 H   0.8237000       1.118600      0.7575000    
 H    2.410800     -0.1708000     -0.7771000    
 H    4.130100       1.583900     -0.9535000    
 H    2.901900       2.840400     -0.8155000    
 H  -0.4501000      -1.656200       2.864700    
 H   2.1299999E-02 -0.1611000       2.119500    
 H   -2.387000     -0.3699000       2.799600    
 H   -2.624300      -1.652400       1.615300    
 H    1.610000       1.928000      -2.830900    
 H    1.387700      0.1843000      -2.984700    
 H    3.003800      0.8505000      -2.966000    
 H   0.4321000      -1.687000      -2.596300    
 H   -1.804700       1.983100      -2.106200    
 H   0.2592000      -3.636400       1.944000    
 H   -4.335900      0.5704000       1.882600    
 H    1.105200      -4.006100      -2.234000    
 H   -4.003500       2.950300      -1.647700    
 H    1.018600      -4.994000      3.8899999E-02
 H   -5.282000       2.238300      0.3560000    
 H    4.002200       3.795000       1.091200    
 H    5.277300       2.557800       1.036100    
 H    4.321000       2.813600       2.512200    
 H    2.804400     -0.2392000       1.321200    
 H    3.822000      0.4926000       2.524000    
 H    4.520300      7.3899999E-02  0.9524000    


%chk=000021772-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000021772

0 1
N 3.218062 1.460682 1.024116
C -0.449990 0.136972 -0.929144
C 0.654645 1.194593 -0.563293
C 2.052194 0.927681 -1.174584
C -0.047789 -1.287305 -0.537284
C -1.825086 0.645661 -0.454505
C 0.051369 -1.723241 0.816774
C -2.440276 0.399453 0.810943
C 3.127967 1.758809 -0.426207
C -0.398319 -0.833291 1.962801
C -1.916077 -0.532723 1.907744
C 2.106556 1.253823 -2.685484
C 0.304653 -2.193699 -1.569650
C -2.499256 1.498237 -1.375035
C 0.511878 -3.035890 1.088223
C -3.688304 1.025724 1.090315
C 0.757278 -3.502810 -1.291324
C -3.735512 2.106359 -1.085950
C 0.868713 -3.926625 0.050824
C -4.339398 1.867870 0.169064
C 3.952408 2.509058 1.761412
C 3.754542 0.113483 1.309205
H -0.509034 0.136457 -2.036086
H 0.293140 2.186200 -0.906321
H 0.771887 1.267660 0.531575
H 2.292623 -0.146729 -1.052023
H 4.117447 1.608175 -0.935143
H 2.874999 2.833586 -0.530181
H -0.187964 -1.348817 2.919020
H 0.168125 0.115266 1.988261
H -2.219056 -0.103657 2.883088
H -2.448951 -1.503046 1.823193
H 1.880858 2.323230 -2.865259
H 1.373700 0.655539 -3.257349
H 3.107399 1.042048 -3.106983
H 0.220971 -1.864958 -2.613429
H -2.029939 1.683670 -2.350143
H 0.584368 -3.364240 2.132803
H -4.156883 0.837412 2.065250
H 1.019251 -4.180195 -2.111851
H -4.220061 2.752680 -1.826250
H 1.221628 -4.936763 0.287414
H -5.299767 2.329375 0.424778
H 3.469531 3.488903 1.596581
H 5.027262 2.597988 1.457783
H 3.924202 2.291720 2.844665
H 3.101089 -0.663221 0.877511
H 3.786282 -0.044961 2.402229
H 4.789535 -0.037844 0.907004


