%chk=000086995.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000086995

0 1
 Br  0.5040000     -0.3003000       2.769900    
 Br  0.9627000      -6.140600     -0.2708000    
 S   -5.517500       2.585700      0.3708000    
 S    5.144600       3.113900      0.3812000    
 O   1.3200000E-02  -1.798200      -1.758200    
 O   0.2610000      -4.004200      -2.403600    
 O   -5.272900       1.116300     -0.3255000    
 O    4.015200       3.028100     -0.8109000    
 O   -7.140500       2.759600      0.3554000    
 O    5.999900       4.454700      1.2800000E-02
 O   -5.088000       2.529200       1.756000    
 O   -4.965600       3.591700     -0.5181000    
 O    4.476600       3.345200       1.648800    
 O    6.034000       1.977200      0.2282000    
 C   3.8999999E-03 -0.9933000     -0.5237000    
 C   0.3593000      -2.050900      0.4797000    
 C   -1.418700     -0.4248000     -0.4702000    
 C    1.086000      9.1200002E-02 -0.6010000    
 C   0.4790000      -3.282100     -0.1383000    
 C   0.2422000      -3.130400      -1.560500    
 C   0.5933000      -1.948100       1.844900    
 C   -1.894400      0.3701000      -1.514500    
 C   0.8684000       1.339900     -1.6200000E-02
 C   -2.242100     -0.7007000      0.6231000    
 C    2.291100     -0.1680000      -1.256700    
 C   0.8062000      -4.442000      0.5424000    
 C   0.9241000      -3.102100       2.562800    
 C    1.027500      -4.342400       1.915000    
 C   -3.188900      0.8877000      -1.465800    
 C    1.852200       2.326200     -8.6800002E-02
 C   -3.536600     -0.1833000      0.6719000    
 C    3.275100      0.8182000      -1.327200    
 C   -4.010000      0.6109000     -0.3727000    
 C    3.055700       2.065400     -0.7422000    
 H   -1.270800      0.5931000      -2.376400    
 H  -5.6699999E-02   1.592400      0.4928000    
 H   -1.950600      -1.344800       1.442300    
 H    2.490600      -1.132300      -1.715100    
 H    1.111400      -3.056900       3.633200    
 H    1.287100      -5.217900       2.505500    
 H   -3.551800       1.503400      -2.284200    
 H    1.673000       3.297100      0.3672000    
 H   -4.175200     -0.4117000       1.520900    
 H    4.210000      0.6082000      -1.839700    
 H   -7.579300       2.540000     -0.4998000    
 H    6.272600       4.533900     -0.9314000    


%chk=000086995-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000086995

0 1
Br 0.462809 -0.322304 2.924379
Br 1.071950 -6.134490 -0.419904
S -5.903921 2.759250 0.526174
S 5.633643 3.093354 0.525341
O -0.011534 -1.645354 -1.821828
O 0.237339 -3.827426 -2.592394
O -5.462091 0.907253 -0.282983
O 4.081672 3.085114 -0.855073
O -7.493278 2.673094 -0.360767
O 6.553476 4.137495 -0.653317
O -6.230375 2.826214 2.097741
O -4.919690 3.852434 -0.134564
O 5.437440 3.945620 1.873734
O 6.259792 1.608941 0.602076
C -0.025721 -0.912220 -0.487349
C 0.369598 -2.019040 0.506062
C -1.464340 -0.397891 -0.353872
C 1.053943 0.181554 -0.581617
C 0.508941 -3.251033 -0.186220
C 0.243478 -3.038517 -1.638704
C 0.614182 -1.970357 1.890286
C -1.930903 0.533098 -1.325909
C 0.833752 1.496928 -0.091955
C -2.358747 -0.878318 0.637776
C 2.320483 -0.157310 -1.133874
C 0.876837 -4.432602 0.491479
C 0.991973 -3.149895 2.573720
C 1.119230 -4.374313 1.881893
C -3.253517 0.995793 -1.296552
C 1.855633 2.458433 -0.149288
C -3.684305 -0.414497 0.687314
C 3.347995 0.794191 -1.204026
C -4.144861 0.516322 -0.288426
C 3.116028 2.119320 -0.723206
H -1.250775 0.876251 -2.111593
H -0.131548 1.764927 0.346329
H -2.022697 -1.609091 1.378350
H 2.492659 -1.164394 -1.525207
H 1.189496 -3.115325 3.648851
H 1.412321 -5.275739 2.426783
H -3.622255 1.714015 -2.034994
H 1.705151 3.474472 0.228691
H -4.383558 -0.763575 1.453481
H 4.327124 0.545318 -1.624381
H -7.382872 1.910326 -1.004412
H 6.020345 4.088276 -1.502744


