%chk=000019438.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000019438

0 1
 N   5.1300000E-02  0.4327000     -0.2002000    
 N   0.7408000     -0.1241000      -1.083800    
 N   -2.009200       1.698400       2.623400    
 N  -0.4704000       4.076300     -0.6997000    
 C   -1.326300      0.6520000     -0.6396000    
 C   -2.226400     -0.5440000     -0.3819000    
 C   -1.871400       1.954100      1.2000001E-03
 C   -2.011700      -1.313600      0.7452000    
 C   -3.235400     -0.8294000      -1.281100    
 C   -2.838400      -2.411800      0.9821000    
 C   -4.062100      -1.927700      -1.044000    
 C    2.047400     -0.3126000     -0.6221000    
 C   -3.863600      -2.718800      8.7600000E-02
 C    4.654500     -0.6896000      0.2966000    
 C    2.388200      -1.488200      4.6999998E-02
 C    3.010500      0.6745000     -0.8320000    
 C    3.691600      -1.676600      0.5065000    
 C    4.314000      0.4860000     -0.3727000    
 C   -1.946700       1.812200       1.470100    
 C   -1.085100       3.142000     -0.3897000    
 C    6.048400     -0.8917000      0.7871000    
 H   -1.312800      0.8216000      -1.728900    
 H   -2.896500       2.109900     -0.3634000    
 H   -1.220000      -1.096600       1.455500    
 H   -3.399500     -0.2179000      -2.163200    
 H   -2.683700      -3.028100       1.862900    
 H   -4.860900      -2.166500      -1.740100    
 H   -4.507300      -3.573900      0.2721000    
 H    1.644900      -2.263500      0.2143000    
 H    2.755000       1.593400      -1.353300    
 H    3.945100      -2.597600       1.024800    
 H    5.055900       1.261400     -0.5440000    
 H    6.518700      6.3100003E-02   1.045700    
 H    6.063500      -1.510800       1.690500    
 H    6.650700      -1.381800      1.5699999E-02


%chk=000019438-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000019438

0 1
N -0.025714 0.232025 -0.245472
N 0.870570 -0.230373 -1.062852
N -1.901981 2.690514 1.779736
N -0.350782 3.456286 -2.288133
C -1.363858 0.341165 -0.902949
C -2.365177 -0.615585 -0.261935
C -1.836401 1.847842 -0.755579
C -2.374241 -0.850174 1.137129
C -3.312324 -1.275651 -1.084382
C -3.328705 -1.725134 1.700691
C -4.268832 -2.147010 -0.517515
C 2.189409 -0.373907 -0.512304
C -4.279912 -2.372295 0.878452
C 4.876061 -0.743369 0.349289
C 3.157901 -0.898716 -1.403136
C 2.561223 -0.029108 0.818159
C 4.487647 -1.082551 -0.972295
C 3.888825 -0.215512 1.233039
C -1.854141 2.309911 0.651740
C -1.008828 2.750809 -1.588519
C 6.307902 -0.918966 0.816468
H -1.281882 0.135550 -1.989889
H -2.878336 1.891728 -1.133499
H -1.632769 -0.358354 1.773823
H -3.296497 -1.115937 -2.169932
H -3.329677 -1.901700 2.781817
H -4.996275 -2.652522 -1.162069
H -5.019029 -3.049949 1.319891
H 2.845169 -1.153095 -2.421136
H 1.803219 0.380682 1.493110
H 5.231877 -1.490244 -1.665619
H 4.178848 0.051086 2.256701
H 6.353333 -1.457975 1.780638
H 6.910836 -1.479116 0.082156
H 6.795643 0.062444 0.972974


