%chk=000012085.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000012085

0 1
 I    4.103600      2.8200001E-02  6.9999998E-04
 O   -2.754300       1.197000      8.9999998E-04
 O   -2.920400      -1.069900      3.0000001E-04
 C  -0.7633000     -3.5100002E-02 -5.0000002E-04
 C  -5.0299998E-02  -1.233900     -3.0000001E-04
 C  -8.1699997E-02   1.181900     -5.0000002E-04
 C    1.344400      -1.215700       0.000000    
 C    1.313100       1.200200     -3.9999999E-04
 C    2.026200      1.3000000E-03 -9.9999997E-05
 C   -2.217500     -5.4000001E-02 -9.9999997E-05
 H  -0.5627000      -2.192400     -9.9999997E-05
 H  -0.5973000       2.138200     -6.9999998E-04
 H    1.880700      -2.161300      3.0000001E-04
 H    1.825000       2.159300     -3.9999999E-04
 H   -3.735000       1.173300      1.6000000E-03


%chk=000012085-Freq.chk
%nprocshared=24
%mem=100GB
#p freq=noraman PBEPBE/SDD

000012085

0 1
I 4.199088 -0.000022 -0.000395
O -2.833978 1.216881 0.000256
O -2.947865 -1.103367 0.000340
C -0.764753 -0.007082 0.000131
C -0.051503 -1.233249 0.000124
C -0.056522 1.221388 -0.000002
C 1.357845 -1.238191 -0.000017
C 1.354005 1.227626 -0.000146
C 2.048845 -0.003867 -0.000154
C -2.250285 -0.060134 0.000269
H -0.613907 -2.172584 0.000229
H -0.612885 2.162572 0.000010
H 1.905927 -2.184181 -0.000021
H 1.899988 2.174875 -0.000251
H -3.823501 1.116435 0.000327


