%chk=000198419.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000198419

0 1
I 3.966558 -0.063240 -0.623476
O -0.204885 0.937283 -0.374283
O 0.530035 -1.239725 -0.258471
O -3.572491 -0.100093 0.479683
C -1.175239 0.238128 0.445775
C -0.542709 -1.140089 0.708943
C 0.926092 0.078882 -0.652388
C -2.472383 0.205321 -0.380097
C 2.092062 0.598247 0.171055
H -1.300263 0.851108 1.363336
H -0.107121 -1.237515 1.716502
H -1.187858 -2.004801 0.488202
H 1.076839 0.056941 -1.749447
H -2.421087 -0.499019 -1.226390
H -2.712730 1.218745 -0.763917
H 2.038771 0.259907 1.217890
H 2.103374 1.702717 0.179758
H -3.605264 -1.058495 0.672024


%chk=000198419-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000198419

0 1
I 3.902079 -0.516113 -0.679140
O -0.191001 1.114162 -0.135514
O 0.381400 -1.172367 -0.349272
O -3.628829 -0.364860 0.313914
C -1.246420 0.298582 0.540364
C -0.526529 -1.038482 0.815031
C 0.857897 0.178940 -0.629995
C -2.465757 0.188529 -0.396136
C 2.141567 0.561805 0.112848
H -1.533000 0.826683 1.465187
H 0.043589 -1.012412 1.763582
H -1.185512 -1.921283 0.803881
H 0.958466 0.268304 -1.724704
H -2.205247 -0.404176 -1.296912
H -2.770271 1.199270 -0.707958
H 2.088122 0.319006 1.184249
H 2.364573 1.628933 -0.032117
H -3.553424 -1.350220 0.367388


