%chk=000030562.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000030562

0 1
 Br  -1.340700      -3.557800       1.882100    
 O  -0.2674000      -1.150100      0.2265000    
 C    1.736700     -0.5720000      -1.017300    
 C    2.181000      0.5479000     -5.2800000E-02
 C    2.403500      -1.939600     -0.7480000    
 C   0.2017000     -0.6603000      -1.022300    
 C    3.688400      0.8209000     -8.2900003E-02
 C    4.120900       1.921600      0.8896000    
 C    2.009000      -3.052300      -1.709500    
 C   -1.685900      -1.233300      0.2551000    
 C    5.619800       2.179600      0.8834000    
 C   -2.244200      0.1530000      2.5900001E-02
 C   -2.146900      -1.801900       1.592300    
 C   -3.464000      0.2942000     -0.6144000    
 C   -1.524800       1.253300      0.4613000    
 C   -3.979300       1.573000     -0.8257000    
 C   -2.040300       2.532100      0.2501000    
 C   -3.267600       2.691900     -0.3934000    
 H    2.037600     -0.2620000      -2.028000    
 H    1.655200       1.476900     -0.3062000    
 H    1.888900      0.2863000      0.9718000    
 H    3.491000      -1.831600     -0.8216000    
 H    2.192200      -2.262100      0.2787000    
 H  -0.1197000      -1.347500      -1.814800    
 H  -0.1797000      0.3228000      -1.308000    
 H    3.987900       1.096400      -1.101300    
 H    4.239800     -8.8100001E-02  0.1792000    
 H    3.813800       1.649700       1.906500    
 H    3.599600       2.852900      0.6383000    
 H    2.157500      -2.744000      -2.749000    
 H    2.622800      -3.940600      -1.527700    
 H   0.9632000      -3.344700      -1.577100    
 H   -2.002600      -1.905200     -0.5547000    
 H    5.872000       2.974300       1.592300    
 H    6.172200       1.279100       1.169700    
 H    5.958100       2.488800     -0.1106000    
 H   -1.810500      -1.193200       2.437500    
 H   -3.231300      -1.933000       1.643900    
 H   -4.025800     -0.5717000     -0.9526000    
 H  -0.5892000       1.161500       1.004000    
 H   -4.935300       1.697400      -1.325900    
 H   -1.491000       3.403100      0.5955000    
 H   -3.670100       3.687500     -0.5556000    


%chk=000030562-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000030562

0 1
Br -1.639301 -3.799720 1.300415
O -0.250779 -1.059472 0.079259
C 1.896397 -0.715272 -1.037141
C 2.312003 0.465396 -0.114752
C 2.448815 -2.077435 -0.532961
C 0.368404 -0.744295 -1.223351
C 3.826947 0.771837 -0.101341
C 4.177537 2.024661 0.734499
C 2.141674 -3.277223 -1.455763
C -1.708345 -1.122033 0.028430
C 5.691477 2.326460 0.762370
C -2.351201 0.272103 -0.015454
C -2.161150 -1.837893 1.306022
C -3.573700 0.478381 -0.700617
C -1.746029 1.357398 0.666585
C -4.188421 1.751127 -0.701013
C -2.358018 2.630046 0.664550
C -3.582269 2.830131 -0.016295
H 2.319400 -0.524371 -2.049635
H 1.772564 1.379199 -0.444489
H 1.965211 0.251805 0.916079
H 3.546050 -1.989339 -0.415890
H 2.030025 -2.272842 0.472445
H 0.066704 -1.518724 -1.960600
H 0.005120 0.242589 -1.583462
H 4.183598 0.918166 -1.143301
H 4.389451 -0.093805 0.302179
H 3.807969 1.884491 1.770995
H 3.631666 2.899841 0.325824
H 2.468793 -3.082281 -2.495754
H 2.666372 -4.184390 -1.103598
H 1.062189 -3.511601 -1.471251
H -2.039448 -1.707476 -0.857917
H 5.915637 3.227031 1.363437
H 6.255891 1.480375 1.198210
H 6.080566 2.496424 -0.259547
H -1.676417 -1.407832 2.195698
H -3.255825 -1.834484 1.410202
H -4.043153 -0.354397 -1.240366
H -0.789535 1.195104 1.176087
H -5.131957 1.902299 -1.237272
H -1.882155 3.465167 1.190933
H -4.056258 3.818056 -0.018149


