%chk=000164651.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000164651

0 1
 I   -1.318300      -2.450500      0.6464000    
 O   0.1995000      0.7740000       1.300000    
 O    2.956900      0.7670000      0.7566000    
 N    1.278400     -0.3137000     -0.4561000    
 N    3.481600     -0.4707000      -1.106500    
 C   -2.358800      0.4110000      5.5000000E-02
 C   -1.142500     -0.4839000     -0.2813000    
 C   -2.206400       1.831400     -0.5083000    
 C   -3.652700     -0.1868000     -0.5206000    
 C   0.1645000      6.3800000E-02  0.2965000    
 C    2.597800      5.8400001E-02 -0.1819000    
 H   -2.476200      0.4952000       1.143300    
 H   -1.050700     -0.6048000      -1.367200    
 H   -1.343100       2.347400     -7.8400001E-02
 H   -2.080300       1.811900      -1.596300    
 H   -3.090400       2.437500     -0.2813000    
 H   -3.556600     -0.3833000      -1.594100    
 H   -4.491300      0.5056000     -0.3835000    
 H   -3.939200      -1.117700     -2.4800001E-02
 H    1.130600     -0.9088000      -1.266600    
 H    4.477900     -0.2903000      -1.042900    
 H    3.165600      -1.053300      -1.874500    


%chk=000164651-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000164651

0 1
I -1.221760 -2.588449 0.035250
O 0.226069 0.836419 1.193955
O 2.959727 1.315290 0.116383
N 1.307626 -0.245286 -0.595138
N 3.588694 -0.711697 -0.856469
C -2.388652 0.394301 0.062498
C -1.152062 -0.364998 -0.449217
C -2.280465 1.872786 -0.419686
C -3.722643 -0.216225 -0.419034
C 0.178324 0.142724 0.151053
C 2.655136 0.208520 -0.383866
H -2.351046 0.391525 1.167795
H -1.120778 -0.382747 -1.554468
H -1.371372 2.362532 -0.035812
H -2.285945 1.934159 -1.525239
H -3.154306 2.437792 -0.048778
H -3.760699 -0.274224 -1.524073
H -4.562808 0.419431 -0.086629
H -3.883654 -1.231053 -0.016827
H 1.155558 -0.935673 -1.336162
H 4.567892 -0.435872 -0.810383
H 3.363465 -1.689858 -1.031655


