%chk=000056150.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000056150

0 1
 I  -0.5681000       3.427000     -0.2796000    
 I   -3.439700      -2.886300      0.2552000    
 O   0.7274000      0.4369000     -0.5046000    
 O    3.095500      -1.963700      0.7083000    
 O    2.273600      -1.602200      -1.381500    
 C    1.584600     -0.1598000      0.4558000    
 C    2.510400      0.9078000       1.041400    
 C    3.368500       1.616000     -1.0000000E-03
 C  -0.6208000      0.3675000     -0.2614000    
 C    2.341500      -1.294900     -0.2001000    
 C   -1.395100       1.514600     -0.1246000    
 C   -1.198700     -0.8933000     -0.1541000    
 C   -2.566900      -1.007900      9.2900001E-02
 C   -2.763200       1.399800      0.1224000    
 C   -3.349000      0.1385000      0.2312000    
 H    1.009000     -0.5970000       1.283700    
 H    3.168900      0.4634000       1.796900    
 H    1.904100       1.665700       1.551200    
 H    3.981100       2.385500      0.4796000    
 H    2.755400       2.104800     -0.7638000    
 H    4.044600      0.9156000     -0.5008000    
 H  -0.5894000      -1.785500     -0.2754000    
 H   -3.393100       2.278800      0.2337000    
 H   -4.416800      7.1699999E-02  0.4240000    
 H    3.582100      -2.711500      0.3004000    


%chk=000056150-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000056150

0 1
I -0.895792 3.552466 -0.575253
I -3.154132 -3.082470 0.584624
O 0.670429 0.960336 0.374546
O 2.591264 -2.155141 0.242160
O 1.768933 -0.890670 -1.533922
C 1.670431 -0.018875 0.807225
C 2.934706 0.785013 1.194856
C 3.554327 1.584368 0.030974
C -0.654008 0.555598 0.193396
C 1.976260 -1.022626 -0.315256
C -1.573892 1.552360 -0.228184
C -1.115845 -0.765860 0.427151
C -2.478466 -1.068000 0.230754
C -2.930153 1.226942 -0.418835
C -3.399334 -0.089598 -0.191471
H 1.308819 -0.577314 1.693204
H 3.666266 0.070204 1.615873
H 2.635629 1.471420 2.008518
H 4.412210 2.176943 0.394889
H 2.814672 2.275702 -0.406001
H 3.918194 0.923568 -0.776450
H -0.427357 -1.549366 0.751980
H -3.633561 1.997163 -0.747763
H -4.454050 -0.328548 -0.345679
H 2.840350 -2.792113 -0.481534


