%chk=000044818.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000044818

0 1
 N    1.107400       2.787500     -0.4443000    
 C  -0.9048000       1.393200     -0.3506000    
 C   -1.727100      0.3040000      0.3539000    
 C   0.5135000       1.616600      0.2158000    
 C   -3.155100      0.1744000     -0.1806000    
 C    1.415100      0.4012000      9.6299998E-02
 C   -3.892700     -0.9860000      0.4890000    
 C   -5.322900      -1.100800     -1.4100000E-02
 C    2.404500      0.2043000       1.040600    
 C    1.222500     -0.4767000     -0.9535000    
 C    3.232900     -0.9126000      0.9310000    
 C    2.050800      -1.593600      -1.062900    
 C    3.055900      -1.811600     -0.1206000    
 H  -0.8930000       1.212000      -1.432300    
 H   -1.463400       2.333800     -0.2336000    
 H   -1.766900      0.5273000       1.427500    
 H   -1.229300     -0.6665000      0.2562000    
 H   0.4046000       1.858000       1.281400    
 H   -3.127300      1.2600000E-02  -1.265000    
 H   -3.697100       1.111700     -6.6000000E-03
 H   -3.905200     -0.8416000       1.575600    
 H   -3.365200      -1.926500      0.2924000    
 H   0.5053000       3.598600     -0.3060000    
 H    1.139100       2.633500      -1.451900    
 H    2.550500      0.8994000       1.862000    
 H   0.4728000     -0.3354000      -1.722700    
 H   -5.887900     -0.1874000      0.1979000    
 H   -5.831500      -1.936500      0.4767000    
 H   -5.345700      -1.276300      -1.094400    
 H    4.016000      -1.082100       1.664200    
 H    1.917400      -2.291000      -1.884800    
 H    3.701800      -2.680400     -0.2068000    


%chk=000044818-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000044818

0 1
N 1.150078 2.764587 -0.233146
C -0.964807 1.344027 -0.339034
C -1.811393 0.255827 0.361538
C 0.453437 1.545625 0.265658
C -3.245298 0.142087 -0.203266
C 1.412158 0.359354 0.087839
C -4.096463 -0.933267 0.510606
C -5.528723 -1.044480 -0.055249
C 2.549043 0.279937 0.933744
C 1.247970 -0.629578 -0.913577
C 3.490595 -0.761179 0.794063
C 2.192354 -1.673537 -1.062332
C 3.314675 -1.745535 -0.208203
H -0.887794 1.131048 -1.425531
H -1.498401 2.314417 -0.259037
H -1.864861 0.483907 1.447294
H -1.305223 -0.726217 0.279573
H 0.316214 1.695312 1.358081
H -3.198031 -0.091297 -1.287978
H -3.754621 1.125504 -0.120074
H -4.142119 -0.699472 1.593963
H -3.586671 -1.914753 0.427057
H 0.598391 3.624137 -0.127351
H 1.518544 2.659022 -1.185124
H 2.695569 1.057887 1.692117
H 0.383588 -0.596499 -1.586399
H -6.070064 -0.084562 0.044545
H -6.114562 -1.819002 0.473269
H -5.511157 -1.308650 -1.129651
H 4.360230 -0.805387 1.459727
H 2.048794 -2.429875 -1.842733
H 4.043549 -2.556286 -0.320589


