%chk=000102932.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000102932

0 1
 Br   2.009900       3.656100      0.8476000    
 O  -0.2597000       2.105000      0.7330000    
 O  -0.7224000      0.2671000      -1.476000    
 O    1.158700      -1.059000       1.339000    
 O    3.114000      0.6600000      0.4279000    
 O   -3.270700      9.3599997E-02  0.7111000    
 O  -0.9850000      -1.925200      -2.155500    
 O   0.9717000      -3.119500      0.3112000    
 O    3.636200      0.2378000      -1.782500    
 O   -5.180700       1.296300      0.2186000    
 C  -0.5026000     -0.1654000     -0.1355000    
 C   0.9924000     -0.4074000      7.8900002E-02
 C   -1.025700      0.9004000      0.8434000    
 C    1.761200      0.9199000      6.8200000E-02
 C    1.119900       1.917200       1.030800    
 C   -2.482800       1.263100      0.5793000    
 C  -0.9524000     -0.7243000      -2.387100    
 C    1.126800      -2.422900       1.305200    
 C    3.947200      0.3284000     -0.6027000    
 C   -1.165500     -0.1252000      -3.744300    
 C    1.313400      -2.965600       2.689500    
 C   -4.615700      0.2489000      0.5034000    
 C    5.329900      8.4799998E-02 -7.8199998E-02
 C   -5.318100      -1.063900      0.6746000    
 H   -1.062800      -1.088000      6.5300003E-02
 H    1.404800      -1.030800     -0.7248000    
 H  -0.9401000      0.5233000       1.871300    
 H    1.702400       1.346000     -0.9437000    
 H    1.256700       1.641100       2.082100    
 H   -2.808800       2.017000       1.307000    
 H   -2.604900       1.699000     -0.4199000    
 H  -0.2719000      0.4247000      -4.050200    
 H   -1.348700     -0.9239000      -4.468700    
 H   -2.036500      0.5345000      -3.724900    
 H    2.284700      -2.653800       3.081700    
 H    1.284600      -4.058500       2.657700    
 H   0.5056000      -2.614600       3.336700    
 H    5.711800      0.9930000      0.3947000    
 H    5.991100     -0.1810000     -0.9080000    
 H    5.314600     -0.7437000      0.6343000    
 H   -5.173100      -1.431000       1.693700    
 H   -6.389600     -0.9279000      0.5016000    
 H   -4.936500      -1.785000     -5.2600000E-02


%chk=000102932-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000102932

0 1
Br 2.169751 3.516488 1.087133
O -0.222707 2.093112 0.915199
O -0.886235 0.287860 -1.373201
O 0.971321 -1.154540 1.489093
O 3.081266 0.454611 0.439504
O -3.459901 0.320482 0.824442
O -2.160347 -1.616353 -1.844055
O 2.611073 -2.598015 0.648614
O 3.458022 0.094336 -1.836858
O -4.343725 0.915480 -1.258649
C -0.670621 -0.196569 0.011797
C 0.832174 -0.506492 0.153418
C -1.100542 0.894994 1.009631
C 1.682267 0.787959 0.122516
C 1.171339 1.775444 1.177698
C -2.505249 1.455243 0.760982
C -1.686238 -0.521424 -2.216853
C 1.924535 -2.191531 1.607034
C 3.884372 0.075003 -0.665105
C -1.894991 0.155667 -3.544296
C 1.972339 -2.686419 3.032827
C -4.323525 0.141067 -0.276917
C 5.245328 -0.361150 -0.190032
C -5.144671 -1.111584 -0.104024
H -1.260393 -1.117249 0.172086
H 1.178571 -1.203389 -0.629446
H -1.019908 0.459118 2.027571
H 1.605865 1.224832 -0.889873
H 1.324277 1.401473 2.206384
H -2.778260 2.163213 1.559082
H -2.562858 1.948022 -0.223245
H -1.033740 0.786684 -3.810509
H -2.084385 -0.596990 -4.324233
H -2.788078 0.802377 -3.456532
H 2.544270 -1.969876 3.650218
H 2.474052 -3.664241 3.068473
H 0.958690 -2.759169 3.458150
H 5.587893 0.261434 0.651474
H 5.963710 -0.318026 -1.021659
H 5.170174 -1.406347 0.163247
H -5.283459 -1.357000 0.959390
H -6.116577 -0.994346 -0.607191
H -4.601477 -1.943587 -0.590085


