%chk=000088972.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000088972

0 1
 Cl   9.184000      -1.466400      0.4533000    
 O   -1.518800      0.8068000       1.500700    
 O   -1.572300       1.835700      -2.976200    
 N    1.018600       1.751000      2.6500000E-02
 N   -1.235500       1.546100     -0.6842000    
 N    3.716000      0.8109000      3.1900000E-02
 N   -2.843900      0.3783000      -1.679200    
 C   -2.947300     -7.5199999E-02 -0.2946000    
 C  -0.1410000       2.476700     -0.4903000    
 C    1.447100      0.7196000     -0.9264000    
 C    2.127400       2.675200      0.2939000    
 C    2.625000     -8.5000001E-02 -0.3719000    
 C    3.328800       1.936100      0.8883000    
 C   -1.820600      0.7954000      0.3120000    
 C   -1.841600       1.319600      -1.899400    
 C   -2.668600      -1.581600     -0.2683000    
 C   -4.274200      0.3068000      0.3730000    
 C    5.004700      0.2746000      0.1311000    
 C   -3.554600      -2.469700     -0.8826000    
 C   -4.493800      6.8000001E-03   1.719400    
 C   -1.527600      -2.072800      0.3704000    
 C   -5.268300      0.9557000     -0.3629000    
 C    5.636700     -0.3065000     -0.9863000    
 C    5.709000      0.2994000       1.351400    
 C   -3.301200      -3.841200     -0.8582000    
 C   -5.700800      0.3538000       2.326500    
 C   -1.274000      -3.444100      0.3946000    
 C   -6.475200       1.302700      0.2441000    
 C   -2.160800      -4.328400     -0.2197000    
 C   -6.691500       1.001700       1.588800    
 C    6.921300     -0.8413000     -0.8872000    
 C    6.993500     -0.2353000       1.450300    
 C    7.599700     -0.8056000      0.3310000    
 H  -0.4786000       3.207300      0.2542000    
 H   7.9300001E-02   3.004100      -1.425800    
 H    1.733400       1.173700      -1.885000    
 H   0.6491000     -1.0000000E-03  -1.134700    
 H    1.810600       3.444600       1.008400    
 H    2.432700       3.190500     -0.6270000    
 H    2.303600     -0.6763000      0.4954000    
 H    2.948500     -0.7928000      -1.143900    
 H    4.154900       2.651600      0.9850000    
 H    3.076900       1.570900       1.892300    
 H   -3.436200      3.1099999E-02  -2.427900    
 H   -4.447100      -2.108600      -1.386800    
 H   -3.738500     -0.5031000       2.311200    
 H  -0.7994000      -1.430800      0.8523000    
 H   -5.143500       1.208500      -1.411100    
 H    5.132100     -0.3342000      -1.949500    
 H    5.263900      0.7239000       2.247800    
 H   -3.991300      -4.529700      -1.337200    
 H   -5.869900      0.1181000       3.373200    
 H  -0.3846000      -3.823900      0.8890000    
 H   -7.247200       1.807000     -0.3299000    
 H   -1.962900      -5.396100     -0.2015000    
 H   -7.631500       1.271400       2.061300    
 H    7.382400      -1.280300      -1.768300    
 H    7.509400     -0.2033000       2.406600    


%chk=000088972-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000088972

0 1
Cl 9.255656 -1.611286 0.627087
O -1.677914 1.158896 1.533402
O -1.388793 1.381679 -3.150372
N 1.047015 1.811021 -0.464710
N -1.365375 1.584741 -0.768070
N 3.704324 0.782149 -0.123273
N -2.814526 0.138400 -1.700803
C -2.991622 -0.079461 -0.243013
C -0.214888 2.514538 -0.662749
C 1.944842 1.701146 -1.632205
C 1.781467 2.071400 0.787423
C 2.961973 0.573424 -1.390929
C 2.815546 0.957335 1.043760
C -1.947336 0.948169 0.327097
C -1.826576 1.055996 -2.018751
C -2.593245 -1.530948 0.114887
C -4.389551 0.324342 0.262067
C 4.979299 0.189986 0.051773
C -3.578558 -2.543214 0.219432
C -4.698350 0.160216 1.637330
C -1.224203 -1.885382 0.230942
C -5.351556 0.900505 -0.600068
C 5.915121 0.133800 -1.028103
C 5.400137 -0.333406 1.313245
C -3.202911 -3.887467 0.438886
C -5.957605 0.554947 2.134743
C -0.850669 -3.227075 0.456536
C -6.616205 1.289726 -0.100721
C -1.838456 -4.234274 0.559189
C -6.924546 1.116351 1.266828
C 7.201560 -0.412172 -0.858390
C 6.693288 -0.870701 1.491125
C 7.582435 -0.908073 0.403873
H -0.428674 3.180960 0.191205
H -0.220269 3.102987 -1.599409
H 2.496668 2.655308 -1.815588
H 1.343039 1.467545 -2.528342
H 1.063161 2.089610 1.625887
H 2.318920 3.050589 0.753954
H 2.412329 -0.395673 -1.353875
H 3.662675 0.531251 -2.238191
H 3.420535 1.247803 1.919671
H 2.275731 0.012101 1.287670
H -3.199865 -0.489748 -2.404440
H -4.639167 -2.281001 0.140267
H -3.946616 -0.260832 2.312998
H -0.446639 -1.115616 0.150218
H -5.109510 1.055149 -1.656651
H 5.656576 0.546590 -2.007618
H 4.716827 -0.349682 2.166412
H -3.974757 -4.661002 0.517805
H -6.183673 0.427895 3.199167
H 0.209108 -3.488210 0.552231
H -7.354867 1.731148 -0.779053
H -1.547180 -5.275900 0.733749
H -7.903425 1.419939 1.654327
H 7.903153 -0.436002 -1.697718
H 6.992442 -1.268115 2.465760


