%chk=000076099.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000076099

0 1
 Br   4.188900       2.862600       1.097600    
 Cl   1.475600      -4.660600      0.5681000    
 O  -0.3728000      0.5715000       2.065700    
 O    1.834000       3.250000     -0.6862000    
 N    1.104800       1.035300     -0.9575000    
 C    1.178200     -0.3097000     -0.5846000    
 C   0.3377000     -0.8588000      0.3568000    
 C  -0.6984000     -1.1000000E-02   1.020500    
 C    2.135800      -1.126800      -1.185500    
 C   0.4044000      -2.183400      0.7299000    
 C   -2.041100      0.1423000      0.4835000    
 C    2.227500      -2.472100     -0.8287000    
 C   0.2877000       1.411000      -2.151900    
 C    1.361900      -3.000500      0.1290000    
 C    1.849800       2.078900     -0.3004000    
 C   -2.401400     -0.5153000     -0.6926000    
 C   -2.968800      0.9472000       1.144700    
 C    2.658900       1.676000      0.9163000    
 C   -3.689300     -0.3679000      -1.207800    
 C   -4.256700       1.094500      0.6298000    
 C   -4.616800      0.4369000     -0.5466000    
 H    2.816800     -0.7270000      -1.932700    
 H  -0.2735000      -2.586900       1.477400    
 H    2.978700      -3.096900      -1.305200    
 H  -0.1460000      0.5230000      -2.619000    
 H   0.9347000       1.931100      -2.864400    
 H  -0.5008000       2.094100      -1.823600    
 H   -1.712500      -1.153000      -1.238000    
 H   -2.713400       1.470500       2.062200    
 H    2.057500       1.782400       1.820800    
 H    3.080800      0.6740000      0.8475000    
 H   -3.970300     -0.8800000      -2.123500    
 H   -4.979300       1.721200       1.144300    
 H   -5.619600      0.5516000     -0.9476000    


%chk=000076099-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000076099

0 1
Br 4.654714 1.136642 0.900133
Cl 0.860602 -4.613335 0.363016
O -0.390136 1.436513 1.211253
O 2.303074 3.436577 -0.676152
N 1.567787 1.253860 -1.046067
C 1.405647 -0.122355 -0.637912
C 0.225291 -0.563328 0.035401
C -0.793170 0.421583 0.561338
C 2.390171 -1.065641 -1.012969
C 0.067018 -1.942715 0.328285
C -2.253226 0.174643 0.341633
C 2.241888 -2.436091 -0.708400
C 0.993841 1.627387 -2.356881
C 1.075041 -2.851474 -0.039535
C 2.194140 2.240499 -0.275567
C -2.734887 -0.721968 -0.652139
C -3.184401 0.906667 1.130017
C 2.742063 1.814103 1.079671
C -4.122954 -0.886291 -0.846979
C -4.568094 0.733518 0.939833
C -5.041085 -0.164681 -0.049112
H 3.284481 -0.713483 -1.535683
H -0.821885 -2.292997 0.861009
H 3.015775 -3.158336 -0.982302
H 1.429112 1.008348 -3.162344
H 1.231717 2.688199 -2.532708
H -0.104599 1.494831 -2.355277
H -2.029551 -1.272138 -1.283715
H -2.794910 1.604768 1.878332
H 2.819014 2.697726 1.725225
H 2.177308 1.006501 1.560778
H -4.488534 -1.571321 -1.619311
H -5.279884 1.294861 1.554283
H -6.118368 -0.296871 -0.198852


