%chk=000028432.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000028432

0 1
 O    1.289300       2.958300     -0.9193000    
 N   0.4690000      0.8559000     -0.3362000    
 N  -0.3854000     -0.1745000     -0.6600000    
 N   -2.149500      0.8746000      0.5333000    
 N   -3.449200      0.9239000      0.9308000    
 C    1.258500      0.6932000      0.8581000    
 C    2.568400      3.3700000E-02  0.5863000    
 C   -1.728500     -0.1409000     -0.2611000    
 C   -2.586800      -1.143300     -0.6876000    
 C    2.675800      -1.355800      0.6462000    
 C    3.686200      0.8067000      0.2722000    
 C   -3.909200      -1.093100     -0.2831000    
 C   -4.298400     -4.3800000E-02  0.5249000    
 C   -2.124800      -2.259600      -1.561000    
 C    3.901000      -1.972400      0.3916000    
 C    4.911400      0.1901000      1.7800000E-02
 C   0.5645000       1.989500      -1.117800    
 C    5.018900      -1.199500      7.7200003E-02
 C   -5.711300      5.7100002E-02  0.9878000    
 H   0.6862000      0.1231000       1.601500    
 H    1.429600       1.678800       1.310100    
 H   5.2200001E-02  -1.061600     -0.8756000    
 H    1.812600      -1.969700      0.8897000    
 H    3.620100       1.890200      0.2254000    
 H   -4.622100      -1.852600     -0.5882000    
 H   -1.403100      -2.888700      -1.029700    
 H   -2.955900      -2.903800      -1.869000    
 H   -1.664800      -1.871700      -2.476100    
 H    3.984600      -3.054300      0.4380000    
 H    5.782000      0.7920000     -0.2259000    
 H  -0.1065000       1.945700      -1.992300    
 H    5.972900      -1.679400     -0.1208000    
 H   -5.856600      0.9408000       1.617900    
 H   -6.388000      0.1385000      0.1312000    
 H   -5.983500     -0.8251000       1.575900    


%chk=000028432-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000028432

0 1
O 1.071724 3.763402 -0.956043
N 0.509458 1.511507 -0.633296
N -0.269211 0.449516 -1.121448
N -1.913657 0.890151 0.520260
N -3.106544 0.609124 1.144500
C 1.234141 1.351170 0.655701
C 2.243843 0.213812 0.605292
C -1.471259 0.078796 -0.492123
C -2.176394 -1.088531 -0.945489
C 2.063997 -0.947176 1.397103
C 3.378325 0.296195 -0.244467
C -3.384737 -1.347672 -0.287819
C -3.836017 -0.484145 0.753310
C -1.640197 -1.954192 -2.063505
C 2.999990 -2.006894 1.346423
C 4.312957 -0.760617 -0.299300
C 0.429143 2.736029 -1.294269
C 4.126052 -1.916722 0.496868
C -5.134724 -0.713837 1.491206
H 0.483989 1.193368 1.451505
H 1.723439 2.327682 0.824582
H 0.245935 -0.264322 -1.642352
H 1.192033 -1.016908 2.059504
H 3.528505 1.196244 -0.853491
H -3.989777 -2.214952 -0.575440
H -0.661582 -2.404024 -1.800661
H -2.332432 -2.782035 -2.289079
H -1.497386 -1.368947 -2.992491
H 2.852834 -2.896550 1.969145
H 5.189131 -0.682002 -0.952845
H -0.256927 2.678602 -2.166674
H 4.854082 -2.734807 0.458331
H -5.257693 0.066393 2.258678
H -6.001179 -0.672301 0.804911
H -5.150266 -1.703058 1.985672


