%chk=000100076.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000100076

0 1
 N   -2.729200       1.233700      0.7685000    
 N    3.144900       1.035300     -0.4022000    
 C   -1.089400     -0.7078000      0.5135000    
 C   -1.308300      0.8345000      0.7940000    
 C   -1.810800      -1.138800     -0.7702000    
 C   -3.287700     -0.7329000     -0.7241000    
 C  -0.4718000       1.794100     -0.1376000    
 C   -3.429700      0.7714000     -0.4385000    
 C   0.3876000      -1.034700      0.4283000    
 C    1.263400     -3.4000000E-03  7.1500003E-02
 C   0.9489000       1.343400     -0.2013000    
 C    2.626300     -0.1925000     -5.1300000E-02
 C   -3.985300      -1.098300      -2.034500    
 C   -3.432200      0.8336000       1.987400    
 C    2.135100       1.973100     -0.4964000    
 C   0.9518000      -2.295800      0.6453000    
 C    3.206300      -1.442300      0.1690000    
 C    2.335900      -2.489900      0.5190000    
 C    4.544000       1.317300     -0.6404000    
 H   -1.505200      -1.268600       1.361200    
 H  -0.9177000       1.025900       1.806300    
 H   -1.328100     -0.6898000      -1.648800    
 H   -1.730700      -2.226100     -0.8984000    
 H   -3.779500      -1.298200      7.7799998E-02
 H  -0.5247000       2.819200      0.2485000    
 H  -0.8735000       1.802700      -1.157000    
 H   -3.058200       1.341300      -1.299400    
 H   -4.493300       1.035800     -0.3703000    
 H   -5.048400     -0.8390000      -1.993200    
 H   -3.540400     -0.5698000      -2.884400    
 H   -3.909800      -2.173600      -2.227300    
 H   -4.462300       1.207200       1.976100    
 H   -2.955400       1.279300       2.867600    
 H   -3.464900     -0.2507000       2.131400    
 H    2.350400       2.998900     -0.7643000    
 H   0.3183000      -3.137000      0.9145000    
 H    4.273700      -1.607500      7.5499997E-02
 H    2.748900      -3.480600      0.6959000    
 H    4.667100       2.371400     -0.9011000    
 H    5.100400       1.093400      0.2732000    
 H    4.885900      0.6882000      -1.466200    


%chk=000100076-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000100076

0 1
N -2.745970 1.190585 0.797920
N 3.209434 1.046298 -0.416086
C -1.089077 -0.718056 0.484295
C -1.303821 0.820539 0.785107
C -1.830486 -1.119093 -0.826420
C -3.334225 -0.749183 -0.765226
C -0.508967 1.773437 -0.170243
C -3.470753 0.764026 -0.426036
C 0.392583 -1.068475 0.430366
C 1.267893 -0.024089 0.062060
C 0.937107 1.345082 -0.229706
C 2.679795 -0.200169 -0.052489
C -4.062465 -1.088076 -2.081861
C -3.442381 0.852731 2.056946
C 2.144091 1.978773 -0.518230
C 0.977092 -2.324443 0.691473
C 3.266664 -1.463479 0.198904
C 2.390897 -2.510039 0.571630
C 4.626328 1.331831 -0.636801
H -1.564343 -1.284250 1.313457
H -0.914251 1.006315 1.806157
H -1.358327 -0.609042 -1.691809
H -1.707563 -2.206139 -1.000661
H -3.798727 -1.335385 0.057183
H -0.635339 2.805826 0.202261
H -0.960823 1.750098 -1.182077
H -3.089571 1.347934 -1.288936
H -4.536993 1.035284 -0.303780
H -5.140602 -0.845267 -2.022230
H -3.633548 -0.514319 -2.926535
H -3.969929 -2.162790 -2.326182
H -4.468710 1.262237 2.024317
H -2.915318 1.329152 2.903542
H -3.522088 -0.239592 2.280509
H 2.352744 3.013919 -0.785747
H 0.350977 -3.173442 0.992606
H 4.345183 -1.638699 0.120494
H 2.812253 -3.500573 0.780304
H 4.749401 2.393151 -0.906169
H 5.220575 1.134560 0.275488
H 5.033662 0.715222 -1.460197


