%chk=000006948.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000006948

0 1
 I    1.701100      -2.506800     -2.5500000E-02
 I   -1.980000      -3.177900      1.9600000E-02
 I   -2.992200       2.683000     -2.7999999E-03
 O    2.594400      0.8774000       1.202300    
 O    2.756900      0.9147000      -1.064500    
 C   0.6732000      0.3559000     -3.0099999E-02
 C   0.2296000     -0.9665000     -1.7700000E-02
 C  -0.2502000       1.401400     -2.5800001E-02
 C   -1.137400      -1.243400     -8.9999998E-04
 C   -1.617300       1.124500     -9.1000004E-03
 C   -2.060800     -0.1979000      3.4000000E-03
 C    2.082600      0.7355000     -4.8799999E-02
 H   0.1018000       2.431100     -3.5900000E-02
 H   -3.129200     -0.4040000      1.6400000E-02
 H    3.541400       1.132900       1.183000    


%chk=000006948-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000006948

0 1
I 1.672269 -2.573171 0.102786
I -1.967540 -3.222273 0.258154
I -3.113454 2.696883 -0.336187
O 2.903426 0.218221 0.945546
O 2.476703 1.930160 -0.554580
C 0.670527 0.402256 0.024930
C 0.255948 -0.962664 0.110049
C -0.292704 1.436693 -0.123357
C -1.139332 -1.242778 0.103514
C -1.662660 1.130560 -0.131889
C -2.096101 -0.203879 -0.004630
C 2.081903 0.916650 0.068165
H 0.069211 2.462880 -0.227955
H -3.160770 -0.444749 -0.000442
H 3.816476 0.615111 0.929496


