%chk=000096912.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000096912

0 1
 Cl   8.292900       1.168000      -1.735000    
 Cl  -8.293100       1.166200       1.735700    
 O    3.712700     -0.1964000      -1.494900    
 O   -3.712800     -0.1978000       1.494800    
 O    6.387800     -0.2000000       2.238700    
 O   -6.387500     -0.1977000      -2.239100    
 N    2.725400     -0.1980000      0.6179000    
 N   -2.725400     -0.1973000     -0.6179000    
 N    5.092300     -0.1982000      0.3536000    
 N   -5.092300     -0.1978000     -0.3538000    
 N    5.218100     -0.1997000       1.840400    
 N   -5.217900     -0.1978000      -1.840800    
 C   0.6802000      -1.405500      0.1536000    
 C  -0.6801000      -1.405400     -0.1548000    
 C   0.6801000       1.010400      0.1549000    
 C  -0.6802000       1.010600     -0.1535000    
 C    1.360300     -0.1977000      0.3084000    
 C   -1.360300     -0.1972000     -0.3083000    
 C    1.406800      -2.704200      0.3180000    
 C   -1.406600      -2.704400     -0.3200000    
 C    1.406300       2.309200      0.3201000    
 C   -1.406700       2.309700     -0.3181000    
 C    3.823800     -0.1976000     -0.2667000    
 C   -3.823700     -0.1979000      0.2665000    
 C    6.314800     -0.1972000     -0.4420000    
 C   -6.314700     -0.1977000      0.4416000    
 C    6.803700       1.206000     -0.7589000    
 C   -6.803900       1.205200      0.7598000    
 H    1.637300      -3.131200     -0.6636000    
 H    2.346100      -2.611800      0.8707000    
 H   0.8119000      -3.423200      0.8916000    
 H  -0.8118000      -3.422700     -0.8944000    
 H   -1.636700      -3.132200      0.6614000    
 H   -2.346200      -2.611500     -0.8723000    
 H   0.8099000       3.031600      0.8876000    
 H    1.647500       2.732400     -0.6605000    
 H    2.339900       2.209900      0.8826000    
 H   -2.340200       2.210600     -0.8807000    
 H  -0.8102000       3.032400     -0.8853000    
 H   -1.647800       2.732300      0.6627000    
 H    2.917300     -0.5535000       1.550500    
 H   -2.917300     -0.5525000      -1.550800    
 H    6.107200     -0.7218000      -1.383200    
 H    7.089600     -0.7869000      6.1900001E-02
 H   -6.107300     -0.7232000       1.382300    
 H   -7.089400     -0.7869000     -6.3000001E-02
 H    6.051700       1.767900      -1.321800    
 H    7.023600       1.764000      0.1564000    
 H   -6.051900       1.766600       1.323300    
 H   -7.023700       1.764000     -0.1551000    


%chk=000096912-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000096912

0 1
Cl 8.101869 2.356184 -1.176600
Cl -8.101672 2.354551 1.180008
O 3.564172 0.690698 -1.381306
O -3.564119 0.689236 1.381849
O 6.467848 -1.068008 1.733660
O -6.468042 -1.066712 -1.734365
N 2.794717 -0.524678 0.493537
N -2.794805 -0.524340 -0.494217
N 5.115987 -0.176032 0.157188
N -5.116054 -0.176136 -0.157274
N 5.264225 -0.911560 1.339860
N -5.264357 -0.910433 -1.340705
C 0.703877 -1.742489 0.093140
C -0.703944 -1.742412 -0.094847
C 0.697050 0.750852 0.145756
C -0.697093 0.750966 -0.145678
C 1.377309 -0.495141 0.229019
C -1.377373 -0.494964 -0.229787
C 1.473089 -3.051775 0.162157
C -1.473188 -3.051625 -0.164849
C 1.434925 2.056789 0.368448
C -1.434904 2.057080 -0.367550
C 3.747832 0.039129 -0.321625
C -3.747863 0.038653 0.321575
C 6.264825 0.346787 -0.616123
C -6.264835 0.345759 0.616750
C 6.620779 1.774795 -0.170249
C -6.620648 1.774411 0.172838
H 1.058992 -3.797254 -0.537238
H 2.535390 -2.910385 -0.096673
H 1.433086 -3.502273 1.174338
H -1.433548 -3.501152 -1.177478
H -1.058867 -3.797786 0.533681
H -2.535401 -2.910452 0.094472
H 0.783857 2.810417 0.840372
H 1.812048 2.471356 -0.585478
H 2.309067 1.908745 1.025210
H -2.309129 1.909478 -1.024295
H -0.783825 2.810915 -0.839134
H -1.811871 2.471155 0.586651
H 3.153049 -1.066951 1.288867
H -3.153192 -1.065975 -1.289954
H 5.983013 0.342706 -1.679939
H 7.117802 -0.330362 -0.440520
H -5.983043 0.340200 1.680568
H -7.117869 -0.331076 0.440219
H 5.810102 2.485471 -0.384231
H 6.933342 1.820967 0.882667
H -5.809897 2.484705 0.387799
H -6.933212 1.822065 -0.880013


