%chk=000104913.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000104913

0 1
 Cl   5.207500      0.6617000      0.9980000    
 Cl  -5.207300      0.6644000      0.9967000    
 O  -1.9999999E-04   1.845300       1.657000    
 O  -3.9999999E-04  -1.933000      0.1274000    
 O   1.7000000E-03   4.117100       2.101300    
 O    4.689600      -2.260800      0.5262000    
 O   -4.690600      -2.259100      0.5265000    
 O    4.878200      -1.902800      -1.779400    
 O   -4.881600      -1.900400      -1.778800    
 C    0.000000      0.9658000      0.4880000    
 C   6.9999998E-04   1.955300     -0.6324000    
 C    1.258500      0.1218000      0.5315000    
 C   -1.258800      0.1224000      0.5306000    
 C   8.9999998E-04   3.241000     -0.1221000    
 C    1.180300      -1.261200      0.3321000    
 C   -1.181000      -1.260800      0.3318000    
 C   5.0000002E-04   3.177600       1.331400    
 C   1.1000000E-03   1.749800      -2.003200    
 C    2.525800      0.6950000      0.7382000    
 C   -2.526000      0.6962000      0.7363000    
 C   1.9000000E-03   4.365100     -0.9268000    
 C    2.335400      -2.050500      0.3281000    
 C   -2.336300      -2.049700      0.3281000    
 C    3.677800     -9.3500003E-02  0.7413000    
 C   -3.678200     -9.2000000E-02  0.7397000    
 C   1.8000000E-03   2.867500      -2.842900    
 C    3.582500      -1.466100      0.5342000    
 C   -3.583300      -1.464800      0.5336000    
 C   2.3000001E-03   4.166500      -2.307800    
 C    5.277100      -2.411000     -0.7399000    
 C   -5.278300      -2.410500     -0.7394000    
 C    6.482200      -3.298800     -0.6433000    
 C   -6.483800      -3.297700     -0.6419000    
 H   7.9999998E-04  0.7493000      -2.422300    
 H    2.614200       1.768400      0.8921000    
 H   -2.614200       1.769700      0.8898000    
 H   2.2000000E-03   5.366000     -0.5104000    
 H    2.259000      -3.123600      0.1683000    
 H   -2.260200      -3.123000      0.1690000    
 H   2.0999999E-03   2.731500      -3.921000    
 H   3.1000001E-03   5.022600      -2.976900    
 H    7.216600      -2.851300      3.0999999E-02
 H    6.935300      -3.404500      -1.633100    
 H    6.184200      -4.288000     -0.2874000    
 H   -6.187700      -4.283300     -0.2745000    
 H   -6.930100      -3.413800      -1.633600    
 H   -7.222500      -2.844000      2.3300000E-02


%chk=000104913-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000104913

0 1
Cl 5.306426 0.670439 -0.085120
Cl -5.306009 0.672523 -0.085125
O 0.000373 1.596275 1.732948
O -0.000329 -2.046321 0.664590
O 0.000764 3.788763 2.549190
O 4.789596 -2.312822 0.448894
O -4.790332 -2.310989 0.448813
O 5.087551 -2.370181 -1.882724
O -5.087943 -2.368845 -1.882850
C 0.000252 0.904368 0.341929
C 0.000506 2.099082 -0.610959
C 1.255939 0.053759 0.279396
C -1.255770 0.054245 0.279360
C 0.000715 3.305216 0.116983
C 1.204880 -1.345362 0.488998
C -1.205261 -1.344895 0.488974
C 0.000631 3.014976 1.577045
C 0.000542 2.109164 -2.017256
C 2.527370 0.651128 0.094980
C -2.526967 0.652107 0.094930
C 0.000959 4.560800 -0.523189
C 2.371204 -2.135470 0.520674
C -2.371889 -2.134554 0.520633
C 3.692723 -0.124069 0.124648
C -3.692619 -0.122641 0.124564
C 0.000789 3.364571 -2.672673
C 3.618345 -1.523724 0.337722
C -3.618785 -1.522330 0.337632
C 0.000995 4.578995 -1.935806
C 5.511916 -2.644160 -0.751084
C -5.512603 -2.642305 -0.751192
C 6.793123 -3.340341 -0.371138
C -6.794157 -3.337836 -0.371260
H 0.000384 1.177483 -2.592278
H 2.601717 1.731258 -0.059792
H -2.600898 1.732269 -0.059815
H 0.001118 5.481717 0.068537
H 2.302890 -3.213716 0.681421
H -2.303992 -3.212824 0.681403
H 0.000821 3.400443 -3.767400
H 0.001185 5.534253 -2.471069
H 7.480629 -2.609826 0.091447
H 7.264794 -3.769046 -1.266659
H 6.599168 -4.127461 0.375856
H -6.600675 -4.124783 0.376039
H -7.265802 -3.766646 -1.266744
H -7.481473 -2.606888 0.090926


