%chk=000018388.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000018388

0 1
 I   3.9099999E-02   2.428900      -1.258500    
 I   -3.069200      -2.657400      9.6799999E-02
 I    2.881600      -2.762700      0.3153000    
 O   -4.213600       1.827800      0.1830000    
 O   -2.577600       1.089400       1.573200    
 O    2.831900       1.222500       1.559100    
 N    2.414700      0.3421000     -0.5861000    
 C   -1.235100     -0.2648000     -0.5301000    
 C    1.179000     -0.3044000     -0.4415000    
 C  -9.9999998E-03  0.3860000     -0.6767000    
 C   -2.519600      0.4683000     -0.7809000    
 C   -1.271300      -1.605900     -0.1484000    
 C    1.142800      -1.645600     -5.9799999E-02
 C  -8.2300000E-02  -2.296300      8.6700000E-02
 C   -3.072800       1.141100      0.4557000    
 C    3.136900       1.040200      0.3849000    
 C    4.425400       1.590900     -0.1727000    
 H   -3.293700     -0.1890000      -1.186500    
 H   -2.424900       1.214300      -1.574000    
 H  -0.1107000      -3.342400      0.3848000    
 H    2.753900      0.3911000      -1.544400    
 H    4.995100      0.7941000     -0.6594000    
 H    5.029100       2.010800      0.6365000    
 H    4.203400       2.377600     -0.8990000    
 H   -4.576400       2.265300      0.9826000    


%chk=000018388-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000018388

0 1
I -0.025314 2.475500 -1.317803
I -3.050844 -2.721107 0.359237
I 2.988369 -2.727076 0.069045
O -4.357314 1.853498 0.079159
O -2.671403 1.258015 1.565716
O 3.092319 0.464113 1.538774
N 2.411334 0.466806 -0.698664
C -1.317933 -0.255600 -0.530610
C 1.189930 -0.236433 -0.497195
C -0.067757 0.397705 -0.715967
C -2.635402 0.438980 -0.790134
C -1.257558 -1.598980 -0.066364
C 1.176722 -1.598741 -0.093116
C -0.037494 -2.269509 0.151532
C -3.166246 1.197658 0.424882
C 3.300547 0.798203 0.343732
C 4.541436 1.558312 -0.109437
H -3.415655 -0.286575 -1.083202
H -2.558909 1.162428 -1.620728
H -0.030493 -3.308648 0.485531
H 2.567008 0.894906 -1.614328
H 5.385343 0.849543 -0.196907
H 4.805008 2.298517 0.662089
H 4.415712 2.070482 -1.079553
H -4.705708 2.339902 0.874912


