%chk=000125236.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000125236

0 1
 Cl   3.106100       1.233500      -1.648000    
 Cl   4.291800       3.355600      0.4533000    
 O   -1.103200       2.125700     -0.7309000    
 O   -3.746200     -0.6503000      0.6513000    
 O    2.682600      -2.957800      -1.155400    
 O  -0.9757000       1.156700      -2.829500    
 O    3.099700      -2.246200       1.007700    
 O   -5.786400     -0.2463000     -0.3359000    
 N   -1.338900      -2.145600      0.1660000    
 N   -5.584900     -0.4067000       1.949000    
 C   0.8081000     -0.4584000     -0.5942000    
 C  -0.6628000     -0.1218000     -0.8585000    
 C    1.003600      -1.870400     -3.2800000E-02
 C   -1.654500     -0.9476000     -0.4544000    
 C    1.405800      0.5525000      0.3415000    
 C  -5.2000001E-02  -2.629100      0.3400000    
 C   -3.127300     -0.6862000     -0.6192000    
 C  -0.9297000       1.112900      -1.614000    
 C   3.2600001E-02  -4.003900      0.9462000    
 C    2.387100      -2.369500      2.8899999E-02
 C    2.460000       1.374900     -4.4199999E-02
 C   0.8697000      0.6465000       1.622600    
 C    2.983300       2.299900      0.8594000    
 C    1.392900       1.571400       2.525900    
 C    2.449700       2.398100       2.144400    
 C   -1.374200       3.402800      -1.317800    
 C    4.004700      -3.497800      -1.251300    
 C   -5.099000     -0.4192000      0.6650000    
 C   -1.542900       4.426300     -0.2152000    
 H    1.278200     -0.4742000      -1.582700    
 H   -2.107300      -2.738300      0.4593000    
 H   -3.567600      -1.492000      -1.220300    
 H   -3.316900      0.2599000      -1.137500    
 H  -0.4511000      -4.013700       1.928900    
 H    1.061900      -4.346700       1.084400    
 H  -0.4749000      -4.731700      0.3042000    
 H   4.6599999E-02  1.8400000E-02   1.951100    
 H   0.9772000       1.648300       3.526400    
 H    2.844500       3.113300       2.861800    
 H   -2.292600       3.344000      -1.912500    
 H  -0.5386000       3.691000      -1.965500    
 H    4.747500      -2.702800      -1.134200    
 H    4.119300      -3.941800      -2.243800    
 H    4.150800      -4.278100     -0.4982000    
 H   -1.750500       5.416900     -0.6289000    
 H   -2.363400       4.141900      0.4519000    
 H  -0.6384000       4.481600      0.3998000    
 H   -6.568500     -0.2487000       2.140200    
 H   -4.975200     -0.5551000       2.746100    


%chk=000125236-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000125236

0 1
Cl 3.659045 0.965754 -1.530715
Cl 5.427250 2.474274 0.702770
O -1.683579 2.206078 -1.214559
O -3.739869 -0.459292 1.168056
O 2.937729 -2.129728 -1.028397
O 0.509947 1.951316 -1.970359
O 2.080475 -4.025537 0.001917
O -5.499808 -0.257118 -0.405211
N -1.399161 -1.481521 0.805473
N -5.769622 -1.372814 1.643391
C 0.954026 -0.415942 -0.422692
C -0.417201 0.283090 -0.484727
C 0.812114 -1.900090 -0.025760
C -1.506667 -0.239497 0.186402
C 1.884103 0.327552 0.567207
C -0.319876 -2.357554 0.626543
C -2.882506 0.406200 0.314928
C -0.450373 1.518446 -1.280614
C -0.580038 -3.745213 1.169296
C 1.943398 -2.808425 -0.312660
C 3.090925 0.973608 0.188316
C 1.510302 0.377713 1.936196
C 3.876526 1.640690 1.158899
C 2.294078 1.041986 2.899082
C 3.490179 1.682676 2.511753
C -1.766928 3.451628 -2.034172
C 4.137242 -2.917241 -1.378247
C -5.069463 -0.663478 0.696751
C -3.159911 4.034891 -1.815295
H 1.420803 -0.348892 -1.418735
H -2.240790 -1.811005 1.286935
H -3.367883 0.538538 -0.665777
H -2.813288 1.392097 0.799279
H -0.888842 -3.687449 2.231398
H 0.318806 -4.369155 1.085439
H -1.399804 -4.232819 0.606849
H 0.584401 -0.119625 2.243085
H 1.983517 1.064992 3.948743
H 4.118172 2.206129 3.238255
H -1.581607 3.184968 -3.090381
H -0.962981 4.136375 -1.709037
H 4.611829 -3.318391 -0.466847
H 4.796341 -2.200970 -1.888335
H 3.865503 -3.755833 -2.041817
H -3.274270 4.958302 -2.411849
H -3.942619 3.322169 -2.127821
H -3.321575 4.288564 -0.753122
H -6.738680 -1.611810 1.451366
H -5.348369 -1.606438 2.539198


