%chk=000072811.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000072811

0 1
 O   0.1546000      -2.911400      0.3901000    
 O    2.378500      -1.543600      0.2607000    
 O    4.446500     -0.1528000     -0.5174000    
 O    4.465400       1.944000      0.3956000    
 N   0.2949000       1.904200     -0.1333000    
 N   -2.513100       1.920000     -0.1594000    
 C  -0.4509000      0.7176000     -1.0500000E-02
 C   0.2372000     -0.5073000      0.1289000    
 C   -1.851800      0.7508000     -2.6100000E-02
 C   -2.548400     -0.4712000      0.1009000    
 C  -0.4608000      -1.704800      0.2533000    
 C   -1.851400      -1.682800      0.2389000    
 C    1.727500     -0.5130000      0.1422000    
 C    2.418500      0.8003000      4.4000000E-03
 C    1.661000       1.896700     -0.1214000    
 C   -3.949600     -0.4433000      8.5699998E-02
 C   -4.624800      0.7600000     -5.1600002E-02
 C   -3.865400       1.904400     -0.1695000    
 C    3.873300      0.9565000     -3.7000000E-03
 C   0.4589000      -3.624200     -0.8077000    
 H   -2.399800      -2.618300      0.3372000    
 H  -0.1871000       2.787600     -0.2350000    
 H    2.077000       2.891900     -0.2309000    
 H   -4.524500      -1.361800      0.1808000    
 H   -5.707600      0.7980000     -6.5300003E-02
 H   -4.335700       2.875900     -0.2796000    
 H   0.9480000      -2.980600      -1.545900    
 H  -0.4581000      -4.043900      -1.233100    
 H    1.135000      -4.445700     -0.5554000    
 H    5.424900     -8.5600004E-02 -0.5393000    


%chk=000072811-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000072811

0 1
O -0.185408 -3.153509 0.063160
O 2.282710 -1.580623 0.784095
O 4.490399 -0.317597 -0.433797
O 4.352999 1.986893 -0.249252
N 0.188039 1.788186 -0.214172
N -2.487879 1.971558 -0.125106
C -0.513174 0.591217 -0.083465
C 0.172691 -0.645371 0.024352
C -1.945906 0.703935 -0.030234
C -2.720991 -0.494726 0.136062
C -0.652824 -1.846724 0.079910
C -2.051296 -1.750994 0.169505
C 1.658764 -0.611653 0.242753
C 2.311877 0.671288 -0.119878
C 1.548498 1.825671 -0.276993
C -4.144917 -0.329243 0.209283
C -4.693925 0.952658 0.116563
C -3.829376 2.082343 -0.052176
C 3.776652 0.863760 -0.244220
C 0.992028 -3.551005 -0.738947
H -2.620157 -2.684117 0.226947
H -0.415036 2.622085 -0.277949
H 2.032100 2.792581 -0.440741
H -4.785973 -1.208610 0.335100
H -5.775439 1.109429 0.170437
H -4.243282 3.093601 -0.128267
H 1.903904 -3.453502 -0.132542
H 1.077377 -2.926220 -1.647446
H 0.793854 -4.598326 -1.016110
H 5.455891 -0.085387 -0.513272


