%chk=000054922.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000054922

1 1
 Cl  0.1548000       6.069300     -0.3609000    
 O   -4.606300     -0.1834000      -1.924200    
 O   -5.385400      -2.401900     -0.4482000    
 N   0.3957000     -0.4734000       1.410500    
 N    1.953400       1.305900     -0.4657000    
 C   0.1691000      -1.904000       1.814300    
 C  -0.5291000      0.2121000      0.8004000    
 C   -1.282100      -2.103500       2.230400    
 C   -1.818700     -0.4544000      0.4295000    
 C   -2.190500      -1.603700       1.144600    
 C    1.753700      9.5200002E-02   1.685200    
 C  -0.3229000       1.658100      0.4858000    
 C    2.391000      0.3800000      0.3361000    
 C   -2.626500      7.1999999E-03 -0.6154000    
 C   -3.399800      -2.242900      0.8546000    
 C   0.8692000       2.125100     -0.1000000    
 C   -3.824000     -0.6473000     -0.9091000    
 C   -4.214100      -1.763800     -0.1708000    
 C   -1.332100       2.564500      0.8495000    
 C    3.572800     -0.4254000     -9.0800002E-02
 C   0.9892000       3.497300     -0.3677000    
 C   -1.184600       3.925000      0.5864000    
 C  -2.7799999E-02   4.390600     -2.9200001E-02
 C    3.709500      -1.738400      0.3492000    
 C    4.530100      0.1421000     -0.9264000    
 C    4.813900      -2.491200     -5.0000001E-02
 C    5.634500     -0.6106000      -1.325800    
 C    5.776400      -1.927300     -0.8876000    
 C   -5.591100      0.7918000      -1.588900    
 C   -5.336300      -3.460900      -1.402200    
 C    6.957800      -2.732000      -1.313700    
 H   0.8316000      -2.142400       2.652300    
 H   0.4411000      -2.522700      0.9517000    
 H   -1.502900      -1.555700       3.155000    
 H   -1.455900      -3.168300       2.423500    
 H    2.329500     -0.6015000       2.297400    
 H    1.636400       1.013400       2.271000    
 H   -2.336600      0.8647000      -1.216300    
 H   -3.703000      -3.119700       1.421400    
 H   -2.238300       2.226200       1.345700    
 H    1.898300       3.868600     -0.8388000    
 H   -1.980300       4.609200      0.8692000    
 H    2.971600      -2.220100      0.9809000    
 H    4.444000       1.167900      -1.274000    
 H    4.910200      -3.518200      0.2924000    
 H    6.377700     -0.1602000      -1.978400    
 H   -6.134200       1.057600      -2.499900    
 H   -5.116900       1.693500      -1.188300    
 H   -6.303000      0.3871000     -0.8625000    
 H   -6.346600      -3.861700      -1.521300    
 H   -4.680300      -4.263500      -1.050700    
 H   -4.990400      -3.090200      -2.372400    
 H    7.832400      -2.093500      -1.478100    
 H    7.235000      -3.463400     -0.5469000    
 H    6.733400      -3.265600      -2.242700    


%chk=000054922-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000054922

1 1
Cl 0.111473 6.163926 -0.504639
O -4.641213 -0.071015 -1.840583
O -5.259557 -2.635442 -0.450071
N 0.478527 -0.467627 1.460682
N 2.100470 1.413856 -0.268560
C 0.330336 -1.937167 1.700216
C -0.501357 0.231030 0.824031
C -1.100196 -2.242252 2.168862
C -1.744081 -0.468629 0.480927
C -2.078166 -1.697049 1.145138
C 1.762930 0.184387 1.813630
C -0.293859 1.655945 0.515798
C 2.528229 0.429092 0.500007
C -2.627583 0.033526 -0.518913
C -3.262588 -2.364786 0.813447
C 0.962962 2.180387 0.017343
C -3.818846 -0.631980 -0.845156
C -4.132872 -1.874289 -0.197684
C -1.390623 2.561959 0.683172
C 3.657716 -0.416927 0.082459
C 1.051588 3.562397 -0.322033
C -1.271332 3.927713 0.403337
C -0.039424 4.410024 -0.110128
C 4.175254 -1.463394 0.898486
C 4.268790 -0.187650 -1.188698
C 5.260366 -2.247361 0.460505
C 5.347880 -0.972834 -1.616246
C 5.869676 -2.019753 -0.800955
C -5.935099 0.472815 -1.343755
C -5.678382 -2.901812 -1.858131
C 7.045224 -2.849417 -1.269828
H 1.069638 -2.231029 2.461526
H 0.560971 -2.477440 0.761051
H -1.277324 -1.784956 3.162852
H -1.218523 -3.332368 2.288220
H 2.299564 -0.447726 2.531286
H 1.550274 1.158223 2.292156
H -2.395607 0.944971 -1.076298
H -3.531759 -3.311098 1.293010
H -2.334808 2.184845 1.086678
H 1.991359 3.929689 -0.741570
H -2.105798 4.611990 0.575736
H 3.750727 -1.675970 1.885751
H 3.877110 0.618834 -1.815511
H 5.646929 -3.043691 1.105874
H 5.803791 -0.778427 -2.593858
H -6.462939 0.826346 -2.240705
H -5.749425 1.317544 -0.655838
H -6.527211 -0.307161 -0.831056
H -6.716170 -3.254347 -1.782165
H -5.033867 -3.701603 -2.261814
H -5.602035 -1.998628 -2.482625
H 7.954018 -2.225550 -1.366026
H 7.273740 -3.671522 -0.572386
H 6.853701 -3.286998 -2.266845


