%chk=000092068.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000092068

0 1
 Br   8.384400      0.9438000     -0.8574000    
 Cl  -1.662400      -2.827200     -0.4468000    
 O  -0.3935000     -0.5515000       1.053300    
 O   -5.471600      0.5112000     -0.8132000    
 C    3.129500      0.4318000      0.1069000    
 C    4.456800     -0.3280000      0.1502000    
 C    1.971700     -0.4445000      0.5938000    
 C    5.619700      0.5555000     -0.3040000    
 C   0.6421000      0.2999000      0.5842000    
 C    6.938700     -0.1933000     -0.2194000    
 C   -1.657100     -0.3082000      0.5802000    
 C   -2.354500      -1.278900     -0.1309000    
 C   -2.229400      0.9353000      0.8276000    
 C   -3.638900      -1.003100     -0.6000000    
 C   -3.513700       1.211200      0.3583000    
 C   -4.218400      0.2419000     -0.3555000    
 C   -6.003300       1.804000     -0.5274000    
 H    3.197900       1.328000      0.7355000    
 H    2.930200      0.7687000     -0.9175000    
 H    4.643100     -0.6809000       1.172000    
 H    4.394700      -1.214900     -0.4921000    
 H    1.888000      -1.341400     -3.2699998E-02
 H    2.173300     -0.8072000       1.609600    
 H    5.441700      0.8913000      -1.333300    
 H    5.662800       1.457700      0.3192000    
 H   0.4290000      0.6451000     -0.4361000    
 H   0.7030000       1.175900       1.240500    
 H    6.944100      -1.086100     -0.8508000    
 H    7.187600     -0.4708000      0.8086000    
 H   -1.696200       1.696200       1.390700    
 H   -4.196500      -1.752300      -1.157300    
 H   -3.904400       2.197200      0.5855000    
 H   -5.414400       2.595600      -1.003000    
 H   -6.118500       1.962500      0.5502000    
 H   -7.006100       1.845000     -0.9653000    


%chk=000092068-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000092068

0 1
Br 8.716686 1.198542 0.127389
Cl -2.206451 -3.149739 0.097428
O -0.346495 -0.838369 0.051209
O -5.827171 0.506706 -0.056187
C 3.249415 0.418655 0.069871
C 4.606786 -0.320950 0.109120
C 2.048110 -0.553557 0.079671
C 5.807217 0.660724 0.100096
C 0.710475 0.188413 0.037011
C 7.138405 -0.091321 0.139164
C -1.674734 -0.400794 0.021240
C -2.687634 -1.399466 0.038534
C -2.084571 0.952308 -0.024215
C -4.047572 -1.073066 0.012573
C -3.455161 1.303941 -0.051162
C -4.439157 0.289895 -0.032763
C -6.286097 1.895681 -0.106680
H 3.183915 1.104756 0.939680
H 3.208705 1.056197 -0.837602
H 4.649824 -0.957914 1.016242
H 4.675231 -1.005359 -0.761146
H 2.103280 -1.237250 -0.788704
H 2.075742 -1.185240 0.987822
H 5.765231 1.293225 -0.806919
H 5.740048 1.340473 0.970673
H 0.623665 0.800699 -0.885706
H 0.595526 0.854411 0.918554
H 7.296695 -0.727317 -0.745844
H 7.270613 -0.679078 1.061040
H -1.336458 1.750016 -0.039270
H -4.815446 -1.850504 0.026591
H -3.730690 2.361621 -0.086058
H -5.930366 2.404838 -1.024036
H -5.954037 2.463051 0.785037
H -7.384128 1.835271 -0.119055


