%chk=000080655.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000080655

0 1
 Br  -5.278300     -0.2390000      0.5038000    
 O    2.873500     -2.6000000E-03 -0.7612000    
 O    3.184000      0.2547000       1.544600    
 C  -0.7203000      0.5868000     -0.2834000    
 C   -1.171300     -0.7365000     -6.3699998E-02
 C   0.6453000      0.8171000     -0.5166000    
 C  -0.2434000      -1.790600     -8.3600000E-02
 C    1.553200     -0.2421000     -0.5329000    
 C   -1.648200       1.640800     -0.2635000    
 C   -2.536900     -0.9669000      0.1696000    
 C    1.109800      -1.543300     -0.3168000    
 C   -3.001300       1.393600     -3.0200001E-02
 C   -3.444800      9.2299998E-02  0.1859000    
 C    3.621800      0.2422000      0.4019000    
 C    5.057100      0.4934000      4.6000000E-02
 H    1.007500       1.829300     -0.6882000    
 H  -0.5674000      -2.815800      8.2699999E-02
 H   -1.323800       2.666000     -0.4298000    
 H   -2.889800      -1.983000      0.3396000    
 H    1.811900      -2.372700     -0.3290000    
 H   -3.695900       2.229800     -2.0400001E-02
 H    5.471600     -0.3840000     -0.4565000    
 H    5.630700      0.6769000      0.9588000    
 H    5.129100       1.375100     -0.5956000    


%chk=000080655-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000080655

0 1
Br -5.502712 -0.381902 0.026042
O 2.858117 0.450909 -0.137191
O 4.011953 -1.535946 0.402996
C -0.832359 0.683369 -0.236541
C -1.249958 -0.654147 0.132621
C 0.562682 0.981492 -0.307637
C -0.245340 -1.635480 0.414283
C 1.508136 -0.006055 -0.024407
C -1.836927 1.668512 -0.518896
C -2.649899 -0.961046 0.206952
C 1.116381 -1.335205 0.342092
C -3.194947 1.356094 -0.442216
C -3.584099 0.030771 -0.076037
C 4.015225 -0.330633 0.082620
C 5.234267 0.537965 -0.133667
H 0.903635 1.984438 -0.583348
H -0.555659 -2.648731 0.693727
H -1.529336 2.682425 -0.798735
H -2.966801 -1.971047 0.485045
H 1.873957 -2.088666 0.557260
H -3.957381 2.109547 -0.657853
H 5.225812 0.959729 -1.153456
H 6.143239 -0.061713 0.015847
H 5.226113 1.386819 0.571998


