%chk=000056149.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000056149

0 1
 I  -0.8482000       3.147600     -0.3690000    
 I   -5.194800     -0.9024000      0.4618000    
 O   0.8303000      0.3494000     -0.5126000    
 O    3.459900      -1.703500      0.7965000    
 O    2.649900      -1.483400      -1.317500    
 C    1.733800     -0.1161000      0.4775000    
 C    2.498100       1.071700       1.064700    
 C    3.282300       1.870300      2.9400000E-02
 C  -0.5030000      0.1082000     -0.2987000    
 C    2.648000      -1.152300     -0.1405000    
 C   -1.423800       1.145600     -0.2000000    
 C  -0.9131000      -1.215800     -0.1820000    
 C   -2.770800      0.8559000      1.8200001E-02
 C   -2.259800      -1.505500      3.5999998E-02
 C   -3.188800     -0.4697000      0.1362000    
 H    1.199700     -0.6124000       1.299900    
 H    3.189900      0.7283000       1.842600    
 H    1.786000       1.751500       1.547100    
 H    3.777600       2.720200      0.5100000    
 H    2.630000       2.263600     -0.7557000    
 H    4.055900       1.256600     -0.4423000    
 H  -0.2061000      -2.035800     -0.2698000    
 H   -3.497200       1.662200      9.6799999E-02
 H   -2.564700      -2.545400      0.1223000    
 H    4.049500      -2.387400      0.4133000    


%chk=000056149-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000056149

0 1
I -1.163801 3.210831 -0.694758
I -5.172770 -1.438816 -0.505199
O 0.704110 0.875465 0.367045
O 2.971618 -1.996127 0.335763
O 2.063579 -0.864832 -1.487588
C 1.814641 0.041352 0.830210
C 2.965139 1.009041 1.198732
C 3.447375 1.885014 0.025018
C -0.555246 0.296229 0.185011
C 2.252474 -0.946915 -0.261609
C -1.587698 1.152650 -0.281116
C -0.860579 -1.061491 0.454344
C -2.896264 0.666040 -0.477870
C -2.167856 -1.557202 0.261540
C -3.177891 -0.691719 -0.203001
H 1.521346 -0.534805 1.729880
H 3.794214 0.401054 1.606910
H 2.590375 1.650153 2.018094
H 4.231359 2.581667 0.371134
H 2.612164 2.476084 -0.386150
H 3.870733 1.279422 -0.796380
H -0.088806 -1.750175 0.810768
H -3.678046 1.337521 -0.839885
H -2.383536 -2.607969 0.471969
H 3.313967 -2.611074 -0.368662


