%chk=000027726.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000027726

0 1
 Br  -5.420600      0.1213000     -0.7868000    
 S   0.4522000       2.018200     -0.7958000    
 O   0.2244000      -1.277100      0.8532000    
 O    3.188700      -2.454400     -0.7631000    
 O    2.887300     -0.8979000      0.9146000    
 N    2.296600       3.882000      -1.050600    
 N    1.415400       3.597900       1.122200    
 C   -1.435100      0.3877000      0.3836000    
 C   -1.045200     -0.9478000      0.4843000    
 C  -0.4699000       1.488100      0.6787000    
 C   -2.739100      0.7070000      4.8000002E-03
 C   -1.959100      -1.964100      0.2062000    
 C   -3.653100     -0.3094000     -0.2734000    
 C   -3.263000      -1.644900     -0.1727000    
 C   0.9919000      -2.039500     -7.6200001E-02
 C    2.449300      -1.707700      0.1089000    
 C    1.475500       3.288400     -0.1335000    
 C    4.603700      -2.247800     -0.7044000    
 H   -1.012000       2.349900       1.086500    
 H   0.2350000       1.176600       1.458200    
 H   -3.041300       1.748900     -7.4400000E-02
 H   -1.672400      -3.009000      0.2884000    
 H   -3.963300      -2.448800     -0.3842000    
 H   0.8412000      -3.104100      0.1284000    
 H   0.7127000      -1.796000      -1.108200    
 H    2.931700       4.627700     -0.7877000    
 H    2.295500       3.592800      -2.022700    
 H    4.844900      -1.208100     -0.9459000    
 H    5.073500      -2.898500      -1.446800    
 H    4.984400      -2.513300      0.2864000    
 H    2.082400       4.354800       1.308600    


%chk=000027726-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000027726

0 1
Br -4.855948 1.015486 0.026729
S 1.255226 2.637122 -0.376711
O 0.970383 -1.022365 0.118244
O 3.145970 -3.810369 -0.612523
O 3.567147 -1.857689 0.600504
N 0.591784 5.120991 -1.143721
N -0.691895 4.245122 0.728817
C -0.639286 0.695048 0.515936
C -0.381079 -0.632805 0.066261
C 0.477649 1.576530 1.008235
C -1.972679 1.168430 0.499281
C -1.430586 -1.464060 -0.390064
C -3.009831 0.332869 0.042260
C -2.758525 -0.977855 -0.402867
C 1.294446 -2.381823 -0.275313
C 2.784928 -2.593960 -0.025347
C 0.224147 4.168615 -0.198625
C 4.562727 -4.214751 -0.429587
H 0.114654 2.321566 1.734206
H 1.325438 0.997702 1.401381
H -2.155481 2.196016 0.828484
H -1.241720 -2.482788 -0.740722
H -3.573262 -1.616322 -0.755676
H 0.726923 -3.124089 0.324292
H 1.075587 -2.562563 -1.346195
H 0.111328 6.017647 -1.182403
H 1.328163 4.935030 -1.822583
H 5.232218 -3.461689 -0.877273
H 4.647333 -5.180022 -0.947044
H 4.794011 -4.315519 0.644020
H -1.207567 5.143393 0.774603


