%chk=000130929.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000130929

0 1
 Br  -4.681700       1.731000     -0.3428000    
 S   0.8105000      0.7858000      0.6040000    
 O   -1.708500       2.419700      0.1612000    
 O    4.460000      0.9558000       1.160300    
 O   -2.568400      -3.028700      5.4000001E-02
 O    3.904700      -1.217800      0.8238000    
 N    3.851500     -0.2180000      -1.944400    
 C    3.179500      0.4140000     -0.8073000    
 C    1.693500      5.0200000E-02 -0.8091000    
 C  -0.8527000      0.1914000      0.3237000    
 C   -1.919200       1.070300      0.1349000    
 C   -1.070800      -1.186000      0.2965000    
 C    3.883100     -4.9400002E-02  0.4545000    
 C   -2.355500      -1.684500      8.0499999E-02
 C   -3.203900      0.5718000     -8.1200004E-02
 C   -3.422000     -0.8056000     -0.1084000    
 H    3.293400       1.500900     -0.9013000    
 H    1.219800      0.4016000      -1.733100    
 H    1.578600      -1.038600     -0.7678000    
 H  -0.2559000      -1.888900      0.4541000    
 H    4.815000      0.1110000      -1.997700    
 H    3.403800      7.5300001E-02  -2.812000    
 H   -4.421700      -1.199800     -0.2766000    
 H  -0.7621000       2.580300      0.3192000    
 H    4.892300      0.6278000       1.977500    
 H   -3.513000      -3.195700     -0.1064000    


%chk=000130929-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000130929

0 1
Br -4.886534 1.096828 -1.050445
S 0.624321 1.487317 0.347711
O -2.089540 2.388463 -0.716563
O 4.648774 -0.747576 0.715220
O -2.021802 -2.995952 0.962697
O 2.415234 -1.372423 0.751460
N 4.027734 0.398690 -1.749606
C 3.150209 0.611399 -0.581893
C 1.694581 0.758946 -1.060135
C -0.891253 0.438544 0.216848
C -2.069513 1.064676 -0.290170
C -0.885222 -0.906404 0.630584
C 3.303763 -0.598582 0.348530
C -2.078557 -1.655700 0.538445
C -3.249313 0.287478 -0.362616
C -3.265908 -1.060554 0.046205
H 3.425979 1.507001 0.030454
H 1.640801 1.447614 -1.918609
H 1.263684 -0.214873 -1.333932
H 0.029694 -1.370708 1.007285
H 4.975791 0.095095 -1.508535
H 4.007013 1.161680 -2.431775
H -4.198090 -1.632718 -0.020527
H -1.167797 2.762377 -0.594364
H 4.749767 -1.541687 1.306994
H -2.903517 -3.435030 0.872838


