%chk=000139703.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000139703

0 1
 O    1.384700       2.038600      8.6499996E-02
 N  -0.8372000       2.458200      4.1400000E-02
 C   0.7291000      0.8455000      3.9799999E-02
 C  -0.6142000       1.108800      1.3000000E-02
 C    1.559600     -0.3240000      3.0400001E-02
 C   -1.660000      0.1264000     -3.8400002E-02
 C   0.3784000       2.955100      8.4600002E-02
 C    1.099600      -1.519700      0.5928000    
 C    2.836200     -0.2794000     -0.5400000    
 C   -2.198300     -0.3819000       1.143800    
 C   -2.137900     -0.3198000      -1.270700    
 C   0.7913000       4.366000      0.1301000    
 C    1.906800      -2.657300      0.5849000    
 C    3.643400      -1.417100     -0.5478000    
 C   -3.214100      -1.336400       1.093800    
 C   -3.153800      -1.274300      -1.320500    
 C    3.178600      -2.606000      1.4600000E-02
 C   -3.691900      -1.782600     -0.1382000    
 H   0.1356000      -1.602300       1.077900    
 H    3.221800      0.6315000     -0.9921000    
 H   -1.838800     -4.3200001E-02   2.112700    
 H   -1.729100      6.6399999E-02  -2.201500    
 H  -8.1299998E-02   5.026000      0.1236000    
 H    1.412300       4.613000     -0.7361000    
 H    1.365900       4.569200       1.038600    
 H    1.548600      -3.581200       1.029700    
 H    4.633200      -1.378000     -0.9930000    
 H   -3.633400      -1.732100       2.014300    
 H   -3.525900      -1.622000      -2.279800    
 H    3.807700      -3.491200      9.8000001E-03
 H   -4.482800      -2.525800     -0.1770000    


%chk=000139703-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000139703

0 1
O 1.445845 1.997879 0.128746
N -0.781981 2.338792 0.458755
C 0.800957 0.725635 0.018184
C -0.569141 0.951605 0.196764
C 1.696352 -0.420817 -0.159033
C -1.736492 0.054121 0.103703
C 0.406745 2.918025 0.404121
C 1.344613 -1.713161 0.324045
C 2.966053 -0.244460 -0.779751
C -2.918862 0.392356 0.817924
C -1.742850 -1.107547 -0.716979
C 0.774440 4.350484 0.582676
C 2.229842 -2.799056 0.168680
C 3.848185 -1.333924 -0.929970
C -4.064601 -0.426089 0.739753
C -2.891402 -1.922542 -0.795484
C 3.483568 -2.618369 -0.462500
C -4.055465 -1.591484 -0.062118
H 0.388718 -1.860296 0.836446
H 3.250917 0.749980 -1.137627
H -2.922475 1.306364 1.420026
H -0.859383 -1.360073 -1.312267
H -0.137346 4.927504 0.797320
H 1.249751 4.758556 -0.327339
H 1.487423 4.480132 1.416452
H 1.945309 -3.785708 0.550768
H 4.819906 -1.181352 -1.412548
H -4.965595 -0.154131 1.301021
H -2.882058 -2.810422 -1.437741
H 4.169063 -3.464646 -0.580608
H -4.945932 -2.226957 -0.124217


