%chk=000114545.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000114545

0 1
Cl -3.002380 1.045340 -1.090021
Cl 0.767438 -2.735393 2.076503
Cl -1.869026 -3.843424 0.842097
O 2.582214 1.370181 0.904852
O -0.582320 1.827529 0.090758
O 2.214314 2.287615 -1.136084
C 3.529516 -0.652993 -0.026492
C 4.819714 -1.424060 -0.332481
C 3.838794 0.753502 0.472502
C 0.550072 2.510013 0.704864
C 1.840094 2.073913 -0.015252
C 4.518506 -2.836625 -0.825816
C 0.254008 3.970443 0.433539
C -0.783990 0.494816 0.351668
C -1.981960 -0.008565 -0.216067
C 0.066722 -0.343877 1.077762
C -0.283717 -1.689928 1.214778
C -2.320948 -1.348905 -0.064645
C -1.462426 -2.192573 0.655912
H 2.891923 -0.600218 -0.932952
H 2.925220 -1.200513 0.726326
H 5.456476 -1.473593 0.572969
H 5.412602 -0.881352 -1.095828
H 4.424543 0.769970 1.408636
H 4.309844 1.391072 -0.296187
H 0.588545 2.262639 1.790728
H 3.952934 -3.413751 -0.084396
H 3.926706 -2.825720 -1.749064
H 5.441816 -3.388531 -1.036077
H -0.751310 4.239739 0.792557
H 0.980536 4.631855 0.921527
H 0.267529 4.191158 -0.647685
H 0.997507 0.024687 1.522287
H -3.243296 -1.742351 -0.501819


%chk=000114545-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000114545

0 1
Cl -3.318900 1.184634 -1.141642
Cl 0.493198 -2.804936 2.143142
Cl -2.344972 -3.888547 0.847120
O 2.631989 1.365366 0.934858
O -0.735068 1.886906 0.118218
O 1.963164 1.926054 -1.237772
C 3.730639 -0.687479 0.025987
C 5.069575 -1.328530 -0.412980
C 3.916519 0.784473 0.414814
C 0.502994 2.450791 0.705087
C 1.749009 1.887796 -0.009961
C 4.902254 -2.813207 -0.802071
C 0.399049 3.962540 0.490582
C -1.030165 0.541310 0.333147
C -2.248336 0.058952 -0.217237
C -0.212852 -0.358104 1.060602
C -0.606717 -1.702029 1.216854
C -2.639133 -1.279107 -0.056357
C -1.814010 -2.169724 0.664824
H 2.998126 -0.758506 -0.800135
H 3.316056 -1.248575 0.886060
H 5.809133 -1.242523 0.409119
H 5.485285 -0.765338 -1.272760
H 4.614169 0.904847 1.259628
H 4.247718 1.390009 -0.448186
H 0.555165 2.194191 1.779791
H 4.508046 -3.403749 0.045790
H 4.196155 -2.924634 -1.645604
H 5.866690 -3.258385 -1.106613
H -0.510544 4.346398 0.980867
H 1.278366 4.472522 0.921720
H 0.348325 4.185148 -0.587761
H 0.734381 -0.034337 1.498205
H -3.579109 -1.632125 -0.487936


