%chk=000006272.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000006272

0 1
 I    2.848900       2.599400     -0.5318000    
 O   -1.818000       1.410600       1.288400    
 O    4.025200     -0.2180000      0.6297000    
 O   -3.481200       1.464500     -0.2615000    
 N   -3.622200      -1.294600     -4.4500001E-02
 C   -1.359200     -0.9238000     -0.9085000    
 C   -2.342800     -0.6398000      0.2350000    
 C   8.2599998E-02 -0.7226000     -0.5000000    
 C   0.6647000      0.5237000     -0.6594000    
 C   0.7914000      -1.789800      2.5300000E-02
 C   -2.629100      0.8436000      0.3583000    
 C    1.994800      0.7083000     -0.2821000    
 C    2.121700      -1.605300      0.4023000    
 C    2.723400     -0.3562000      0.2488000    
 H   -1.582800     -0.2994000      -1.784600    
 H   -1.469700      -1.961200      -1.254800    
 H   -1.976700      -1.025400       1.193400    
 H   8.6999997E-02   1.344200      -1.077400    
 H   0.3308000      -2.765300      0.1513000    
 H   -4.011600     -0.9456000     -0.9194000    
 H   -4.295700      -1.069800      0.6867000    
 H    2.682700      -2.439200      0.8157000    
 H   -1.993800       2.370200       1.390600    
 H    4.295000      0.7012000      0.4611000    


%chk=000006272-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000006272

0 1
I 2.945121 2.617306 -0.917622
O -2.565001 1.109935 1.845191
O 4.111978 -0.123532 0.593241
O -2.326731 1.757012 -0.374948
N -3.745734 -1.110115 -0.164911
C -1.385844 -1.020051 -0.932300
C -2.383840 -0.670624 0.201711
C 0.066585 -0.763938 -0.558274
C 0.681938 0.481521 -0.843622
C 0.833046 -1.757449 0.106125
C -2.383406 0.843038 0.480946
C 2.020344 0.714091 -0.469780
C 2.168482 -1.523809 0.478747
C 2.784439 -0.279680 0.195791
H -1.662212 -0.434084 -1.829369
H -1.546743 -2.087980 -1.163956
H -2.092201 -1.191384 1.129020
H 0.106001 1.262373 -1.349715
H 0.379701 -2.731077 0.326904
H -4.110606 -0.670627 -1.016784
H -4.420263 -1.102648 0.606043
H 2.768035 -2.285211 0.986141
H -2.622528 2.094601 1.987647
H 4.444840 0.782034 0.346375


