%chk=000005345.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000005345

0 1
 Br  0.1328000     -0.3095000      -2.332700    
 Br  -4.461800      -3.419000       1.312600    
 Br  -2.333000      -2.001700      -3.865900    
 Br  -4.654500      -3.544600      -2.032300    
 S    4.645800      0.1599000      -1.013100    
 S   -1.961800       4.041000     -0.9530000    
 O  -0.6875000     -0.9456000       2.273100    
 O   -2.483200      -2.116800       3.138200    
 O    5.068900      -2.574200      0.1790000    
 O  -0.3185000       5.170300       1.305400    
 O    4.862900     -0.6167000      -2.434300    
 O  -0.8709000       4.806300      -1.898800    
 O    4.027500       1.441000      -1.317400    
 O    5.890700      9.3400002E-02 -0.2653000    
 O   -2.654500       3.077900      -1.794700    
 O   -2.701800       5.047200     -0.2091000    
 C  -0.1713000     -0.5053000      0.9647000    
 C   -1.163000      -1.170500      5.6000002E-02
 C    1.243600      -1.057600      0.7502000    
 C  -0.2153000       1.024600       1.051800    
 C   -2.128200      -1.830000      0.7948000    
 C   -1.840700      -1.674900       2.207300    
 C   -1.211200      -1.225200      -1.331000    
 C    2.191400     -0.3036000      5.5900000E-02
 C  -0.9693000       1.756600      0.1326000    
 C    1.586600      -2.315800       1.248400    
 C   0.4987000       1.689600       2.050200    
 C   -3.169000      -2.538200      0.2196000    
 C    3.478000     -0.8058000     -0.1393000    
 C   -1.009300       3.148700      0.2119000    
 C   -2.251800      -1.931300      -1.943800    
 C   -3.226400      -2.581900      -1.172300    
 C    2.873100      -2.818200       1.052900    
 C   0.4590000       3.081700       2.129200    
 C    3.818900      -2.063200      0.3591000    
 C  -0.2951000       3.811300       1.210100    
 H    1.949600      0.6871000     -0.3134000    
 H   -1.578600       1.269700     -0.6149000    
 H   0.8677000      -2.927400       1.786000    
 H    1.088800       1.138000       2.777500    
 H    3.131600      -3.799300       1.442200    
 H    1.017500       3.591600       2.909600    
 H    5.607700      -1.991000     -0.3773000    
 H  -0.8142000       5.563200      0.5708000    
 H    4.058700     -0.6972000      -2.999300    
 H  -0.2595000       4.217400      -2.400600    


%chk=000005345-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000005345

0 1
Br 0.190130 -0.425932 -2.455618
Br -4.539813 -3.343115 1.359328
Br -2.353170 -2.100951 -3.916159
Br -4.734464 -3.550756 -2.025568
S 4.931970 0.059241 -0.749637
S -2.253775 4.056085 -0.899157
O -0.580392 -0.906396 2.331950
O -2.402342 -1.987139 3.287210
O 5.087383 -2.950537 0.274891
O -0.345157 5.264056 1.332990
O 4.342926 -0.102471 -2.500109
O -1.137367 4.103779 -2.373375
O 4.890258 1.620553 -0.352870
O 6.334776 -0.777962 -0.595853
O -3.573954 3.216862 -1.286187
O -2.400831 5.587085 -0.326321
C -0.106524 -0.494146 0.942625
C -1.136696 -1.182909 0.027375
C 1.302696 -1.081880 0.786175
C -0.172620 1.034240 0.941751
C -2.128793 -1.810006 0.815684
C -1.808098 -1.620371 2.265166
C -1.192439 -1.262806 -1.376536
C 2.355225 -0.342397 0.219904
C -1.057219 1.757098 0.123711
C 1.549920 -2.431958 1.166866
C 0.629570 1.753897 1.877019
C -3.204715 -2.513923 0.233675
C 3.607788 -0.957710 0.046029
C -1.106925 3.158430 0.241459
C -2.265156 -1.976477 -1.985767
C -3.273160 -2.594698 -1.184585
C 2.804633 -3.027542 0.995832
C 0.559574 3.145810 1.990188
C 3.884748 -2.306306 0.414417
C -0.316670 3.903871 1.163289
H 2.212030 0.695235 -0.096339
H -1.716274 1.259187 -0.593957
H 0.748507 -3.017230 1.628375
H 1.296436 1.199411 2.544826
H 2.997263 -4.059692 1.301041
H 1.165405 3.693522 2.716885
H 5.800731 -2.318359 -0.087042
H -1.075155 5.690001 0.763445
H 4.910037 0.497024 -3.069126
H -1.651198 4.500282 -3.137300


