%chk=000077055.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000077055

0 1
 O    5.594800     -0.2827000     -0.2560000    
 N    1.469400      0.4089000     -0.1057000    
 C    4.281500     -0.2813000      0.2888000    
 C    1.907000     -0.9928000     -0.1744000    
 C    2.299600       1.181200      0.8298000    
 C    3.364900      -1.091800     -0.6220000    
 C    3.769800       1.151100      0.4135000    
 C   5.9799999E-02  0.4866000      0.2772000    
 C  -0.8547000     -0.2430000     -0.7036000    
 C   -2.314000     -0.1454000     -0.3319000    
 C   -2.871300      -1.109900      0.4934000    
 C   -3.071700      0.9073000     -0.8213000    
 C   -4.220100      -1.019600      0.8373000    
 C   -4.420400      0.9975000     -0.4772000    
 C   -4.994500      3.4000002E-02  0.3521000    
 H    4.327400     -0.7420000       1.282900    
 H    1.342800      -1.558900     -0.9202000    
 H    1.780000      -1.494600      0.7937000    
 H    2.199200      0.7950000       1.852800    
 H    1.970700       2.227400      0.8427000    
 H    3.684500      -2.141100     -0.6315000    
 H    3.466200     -0.7415000      -1.658200    
 H    3.902000       1.677200     -0.5414000    
 H    4.380000       1.699700       1.141000    
 H  -0.2438000       1.541400      0.3127000    
 H  -8.9500003E-02  8.6599998E-02   1.289700    
 H  -0.7114000      0.1517000      -1.718600    
 H  -0.6262000      -1.312100     -0.7664000    
 H    5.886300      -1.208400     -0.3175000    
 H   -2.276200      -1.932700      0.8790000    
 H   -2.632900       1.663400      -1.466100    
 H   -4.667100      -1.769300       1.483700    
 H   -5.023500       1.818200     -0.8544000    
 H   -6.044600      0.1045000      0.6203000    


%chk=000077055-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000077055

0 1
O 5.719342 -0.043558 -0.295139
N 1.468097 0.219813 -0.044944
C 4.363056 -0.184474 0.266944
C 2.037504 -1.149719 -0.020765
C 2.283374 1.155941 0.773363
C 3.487389 -1.153082 -0.552204
C 3.739228 1.216062 0.267872
C 0.034026 0.257875 0.328875
C -0.898104 -0.318370 -0.772189
C -2.364063 -0.161207 -0.397171
C -3.036352 -1.163813 0.349070
C -3.080220 1.014010 -0.744327
C -4.385313 -0.999710 0.737795
C -4.429206 1.183543 -0.358801
C -5.087002 0.176493 0.385486
H 4.426806 -0.558747 1.315657
H 1.416674 -1.811120 -0.650059
H 2.020959 -1.573785 1.020395
H 2.278031 0.860205 1.856643
H 1.827012 2.160690 0.708262
H 3.895013 -2.183699 -0.503857
H 3.493279 -0.828242 -1.609276
H 3.758605 1.609056 -0.765072
H 4.337517 1.893382 0.904365
H -0.244603 1.316071 0.493977
H -0.164256 -0.279165 1.292642
H -0.670238 0.212600 -1.714597
H -0.667977 -1.388179 -0.933692
H 6.134433 -0.941320 -0.359344
H -2.500272 -2.082351 0.620124
H -2.577788 1.796572 -1.327016
H -4.889219 -1.787282 1.309970
H -4.967792 2.095395 -0.641575
H -6.133939 0.304711 0.682790


