%chk=000104181.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000104181

0 1
 N    2.497400      -1.598300      -1.129600    
 C  -0.3939000     -0.3446000      0.9519000    
 C    2.451600      -1.009400      0.2130000    
 C   0.1259000      -1.787800      0.7914000    
 C    1.604300      -1.880800       1.149100    
 C   0.5887000      0.7240000      0.4795000    
 C    1.925700      0.4102000      0.1572000    
 C   -1.778000     -0.2438000      0.3230000    
 C   0.1846000       2.072600      0.4444000    
 C    2.801300       1.437600     -0.2398000    
 C    1.065900       3.080200      5.2299999E-02
 C   -1.902500      0.1006000      -1.018900    
 C   -2.906700     -0.4966000       1.095700    
 C    2.373000       2.762000     -0.2953000    
 C    3.011600      -2.956200      -1.074200    
 C   -3.169700      0.1934000      -1.594600    
 C   -4.173900     -0.4040000      0.5200000    
 C   -4.305300     -5.8899999E-02 -0.8251000    
 H  -0.4983000     -0.1594000       2.032000    
 H    3.469700     -0.9719000      0.6246000    
 H  -4.0600002E-02  -2.158100     -0.2277000    
 H  -0.4492000      -2.455100       1.446600    
 H    1.732100      -1.513900       2.178000    
 H    1.926300      -2.925400       1.190000    
 H    1.575000      -1.598500      -1.561900    
 H  -0.8249000       2.355800      0.7339000    
 H    3.830900       1.206400     -0.5036000    
 H   -1.034900      0.2787000      -1.647800    
 H   -2.816900     -0.7680000       2.143800    
 H   0.7317000       4.113200      2.5300000E-02
 H    3.061800       3.544100     -0.6004000    
 H    3.909600      -3.041000     -0.4530000    
 H    3.301400      -3.257100      -2.087000    
 H    2.260500      -3.680500     -0.7451000    
 H   -3.272100      0.4565000      -2.643300    
 H   -5.058200     -0.6013000       1.118800    
 H   -5.292000      1.1800000E-02  -1.273600    


%chk=000104181-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000104181

0 1
N 2.773896 -1.597845 -1.035174
C -0.472655 -0.366683 0.946517
C 2.444453 -1.098925 0.325911
C 0.022168 -1.813480 0.661440
C 1.470922 -1.993831 1.145815
C 0.557215 0.678048 0.481832
C 1.911142 0.333482 0.206534
C -1.877307 -0.172032 0.369152
C 0.164442 2.039839 0.368255
C 2.817849 1.344593 -0.204269
C 1.076602 3.039285 -0.022276
C -2.079514 0.029210 -1.021762
C -3.015928 -0.268616 1.207775
C 2.416475 2.689333 -0.318533
C 3.468734 -2.890384 -1.126480
C -3.381771 0.128321 -1.557065
C -4.322992 -0.170934 0.676830
C -4.510903 0.026369 -0.709902
H -0.555443 -0.271264 2.051418
H 3.411187 -1.061950 0.871498
H -0.038864 -2.013026 -0.428346
H -0.658368 -2.534105 1.151380
H 1.538676 -1.719569 2.218684
H 1.783015 -3.052326 1.066041
H 1.990299 -1.498097 -1.691337
H -0.876499 2.309626 0.581028
H 3.846279 1.050521 -0.443643
H -1.210043 0.126463 -1.682931
H -2.876507 -0.419792 2.286079
H 0.747416 4.081775 -0.100013
H 3.133814 3.456543 -0.630905
H 4.407272 -2.841787 -0.541579
H 3.743929 -3.084175 -2.178893
H 2.893662 -3.773991 -0.758269
H -3.518528 0.287088 -2.633053
H -5.190197 -0.245503 1.342994
H -5.522030 0.104320 -1.125153


