%chk=000084449.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000084449

0 1
 I   -3.265400       1.756100     -8.9999998E-04
 O    2.975300     -0.4937000     -1.3000000E-03
 C   0.6444000     -0.1318000      1.0000000E-03
 C  -0.3933000      0.8004000      8.9999998E-04
 C   0.3561000      -1.496600      3.9999999E-04
 C    2.027700      0.3174000     -3.0000001E-04
 C   -1.719400      0.3676000      3.0000001E-04
 C  -0.9699000      -1.929300     -9.9999997E-05
 C   -2.007600     -0.9973000     -3.0000001E-04
 C    2.352100       1.807300      3.0000001E-04
 H  -0.1912000       1.867600      8.9999998E-04
 H    1.146800      -2.242200      1.9999999E-04
 H   -1.194500      -2.992000     -6.9999998E-04
 H   -3.033700      -1.356100     -1.0000000E-03
 H    1.956800       2.280400      0.9029000    
 H    1.956300       2.281100     -0.9017000    
 H    3.439200       1.936400      9.9999997E-05


%chk=000084449-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000084449

0 1
I -3.366787 1.787594 0.000100
O 3.014073 -0.541370 -0.000253
C 0.644064 -0.119227 -0.000021
C -0.423565 0.818722 0.000072
C 0.354551 -1.510082 -0.000194
C 2.087410 0.319861 0.000046
C -1.754151 0.354927 -0.000018
C -0.980775 -1.955892 -0.000267
C -2.050193 -1.026183 -0.000181
C 2.406820 1.809974 0.000467
H -0.218252 1.892298 0.000201
H 1.194803 -2.211829 -0.000275
H -1.205250 -3.027749 -0.000389
H -3.086855 -1.375430 -0.000240
H 1.982306 2.308349 0.892011
H 1.982636 2.308725 -0.891032
H 3.498865 1.942612 0.000676


