%chk=000028966.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000028966

0 1
 N    3.431200       2.229400      -1.175400    
 N   -3.431300       2.229500       1.175200    
 C   0.7635000     -0.2210000      5.6899998E-02
 C  -0.7634000     -0.2211000     -5.6899998E-02
 C    1.352600       1.036500     -0.6274000    
 C   -1.352700       1.036600      0.6272000    
 C    1.189300     -0.2210000       1.543700    
 C    1.351200      -1.477800     -0.6265000    
 C   -1.189300     -0.2212000      -1.543700    
 C   -1.351200      -1.477800      0.6267000    
 C    2.893000       1.041100     -0.5150000    
 C   -2.893000       1.041200      0.5149000    
 C    2.722600     -0.2248000       1.664000    
 C    2.884900      -1.485100     -0.5115000    
 C   -2.722500     -0.2250000      -1.663900    
 C   -2.885000      -1.485000      0.5116000    
 C    3.288900       1.029800      0.9767000    
 C    3.451200     -0.2283000      -1.194700    
 C   -3.288800       1.029700     -0.9768000    
 C   -3.451300     -0.2281000       1.194700    
 C    3.282600      -1.478700      0.9734000    
 C   -3.282500      -1.478900     -0.9732000    
 H    1.097900       1.078800      -1.691400    
 H   0.9847000       1.960100     -0.1688000    
 H   -1.097900       1.078900       1.691400    
 H  -0.9847000       1.960100      0.1686000    
 H   0.8235000      -1.100900       2.081200    
 H   0.8287000      0.6616000       2.080200    
 H    1.109200      -1.523200      -1.692500    
 H   0.9920000      -2.405500     -0.1714000    
 H  -0.8236000      -1.101100      -2.081100    
 H  -0.8286000      0.6613000      -2.080200    
 H   -1.109300      -1.523000       1.692600    
 H  -0.9919000      -2.405500      0.1716000    
 H    3.011200     -0.2269000       2.721300    
 H    3.288500      -2.381000     -0.9970000    
 H   -3.011200     -0.2272000      -2.721200    
 H   -3.288500      -2.380800      0.9972000    
 H    2.910900       1.928200       1.482500    
 H    4.381600       1.044600       1.084400    
 H    4.547800     -0.2438000      -1.138700    
 H    3.190200     -0.2400000      -2.261200    
 H   -2.910800       1.928100      -1.482800    
 H   -4.381500       1.044500      -1.084600    
 H   -4.547900     -0.2437000       1.138700    
 H   -3.190300     -0.2398000       2.261300    
 H    4.375200      -1.502100       1.068400    
 H    2.901400      -2.380800       1.467500    
 H   -4.375100      -1.502300      -1.068300    
 H   -2.901300      -2.381100      -1.467300    
 H    4.446100       2.248000      -1.081300    
 H    3.089000       3.069500     -0.7102000    
 H   -4.446200       2.248000       1.081200    
 H   -3.089200       3.069600      0.7100000    


%chk=000028966-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000028966

0 1
N 3.494108 2.156790 -1.359052
N -3.494524 2.156385 1.358676
C 0.798285 -0.225458 0.069683
C -0.798241 -0.225616 -0.069621
C 1.436670 0.982456 -0.691391
C -1.436867 0.982307 0.691238
C 1.244039 -0.133624 1.566279
C 1.426676 -1.529719 -0.524344
C -1.243996 -0.134119 -1.566232
C -1.426390 -1.529897 0.524619
C 2.984643 1.010744 -0.564737
C -2.984848 1.010295 0.564561
C 2.790730 -0.143028 1.701283
C 2.975165 -1.520428 -0.403439
C -2.790686 -0.143827 -1.701255
C -2.974880 -1.520901 0.403701
C 3.372612 1.079454 0.943484
C 3.554642 -0.300482 -1.163178
C -3.372815 1.078671 -0.943675
C -3.554601 -0.300935 1.163225
C 3.371388 -1.444901 1.093866
C -3.371112 -1.445702 -1.093619
H 1.201218 0.941353 -1.770485
H 1.027925 1.939356 -0.304053
H -1.201427 0.941425 1.770343
H -1.028292 1.939219 0.303750
H 0.818825 -0.978358 2.142907
H 0.858542 0.797907 2.022766
H 1.142570 -1.640764 -1.589465
H 1.039168 -2.416423 0.012648
H -0.818627 -0.978871 -2.142722
H -0.858660 0.797405 -2.022869
H -1.142258 -1.640723 1.589757
H -1.038727 -2.416614 -0.012236
H 3.059673 -0.078194 2.774886
H 3.376001 -2.453102 -0.848537
H -3.059625 -0.079230 -2.774873
H -3.375554 -2.453572 0.848953
H 2.983574 2.023229 1.379827
H 4.478370 1.104296 1.037513
H 4.662893 -0.295922 -1.089172
H 3.295848 -0.343474 -2.238534
H -2.983960 2.022447 -1.380177
H -4.478577 1.103276 -1.037720
H -4.662853 -0.296608 1.089199
H -3.295813 -0.343688 2.238592
H 4.475067 -1.457699 1.199900
H 2.979163 -2.328454 1.636569
H -4.474788 -1.458711 -1.199653
H -2.978731 -2.329279 -1.636169
H 4.521915 2.187988 -1.393943
H 3.115214 3.059464 -1.042007
H -4.522337 2.187377 1.393594
H -3.115832 3.059077 1.041440


