%chk=000044848.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000044848

0 1
 Br   4.253600     -1.0900000E-02  -1.113700    
 Br   2.753100      -1.600500       1.247900    
 Br   2.750500       1.633600       1.208400    
 O   0.2663000      5.0000002E-04  7.7200003E-02
 O   -1.051100     -2.3900000E-02  -1.816800    
 C   -2.074900      4.0000002E-03  0.3883000    
 C   -2.927100      -1.262500      0.2065000    
 C   -2.925800       1.266400      0.1747000    
 C  -0.9188000     -8.8999998E-03 -0.5995000    
 C   -2.131700      -2.542800      0.4283000    
 C   -2.145100       2.550600      0.4244000    
 C    1.441600     -8.7000001E-03 -0.7389000    
 C    2.709600      2.9000000E-03  0.1132000    
 H   -1.675600      1.5100000E-02   1.410900    
 H   -3.764000      -1.241400      0.9149000    
 H   -3.361400      -1.288600     -0.8006000    
 H   -3.325800       1.289600     -0.8465000    
 H   -3.786200       1.243400      0.8545000    
 H   -1.348300      -2.668800     -0.3253000    
 H   -2.795100      -3.411300      0.3647000    
 H   -1.663500      -2.546800       1.417800    
 H   -1.329500       2.673500     -0.2947000    
 H   -2.807400       3.416900      0.3270000    
 H   -1.720600       2.561100       1.433300    
 H    1.413800      0.8710000      -1.396000    
 H    1.415300     -0.9044000      -1.374100    


%chk=000044848-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000044848

0 1
Br 4.335760 -0.004178 -1.158233
Br 2.794758 -1.641076 1.247003
Br 2.794761 1.649081 1.235791
O 0.308299 0.000291 0.076110
O -1.010358 -0.005170 -1.843024
C -2.092924 0.002122 0.389528
C -2.946467 -1.285281 0.193236
C -2.949931 1.285080 0.180219
C -0.934265 -0.001420 -0.594093
C -2.177063 -2.593001 0.474753
C -2.184313 2.597598 0.449384
C 1.492801 -0.002869 -0.801281
C 2.739250 0.000076 0.089756
H -1.667799 0.007758 1.410524
H -3.819159 -1.211549 0.870960
H -3.339742 -1.292306 -0.841754
H -3.342633 1.280859 -0.854991
H -3.822761 1.215610 0.858235
H -1.335916 -2.726719 -0.230376
H -2.841572 -3.469248 0.368972
H -1.761680 -2.601801 1.499643
H -1.342956 2.726735 -0.256378
H -2.851060 3.470982 0.334398
H -1.769911 2.617605 1.474521
H 1.488496 0.894003 -1.446541
H 1.488285 -0.904082 -1.440462


