%chk=000178315.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000178315

0 1
 Br  -5.881500       1.029300     -0.2435000    
 Br  -3.507400       1.630700      -2.186400    
 Si   3.242200     -0.1817000     -0.5401000    
 O    1.784800      0.2384000      0.1704000    
 O   -1.815900      -2.381900       1.487700    
 C   -3.187000      0.1774000      0.4816000    
 C   -1.934400     -0.4762000     -7.0500001E-02
 C   -3.211700       1.658100      0.7846000    
 C  -0.6513000      0.2683000      0.4211000    
 C   -3.950400       1.130900     -0.4103000    
 C   -1.968200       2.480700      0.6600000    
 C   -1.884200      -2.019100      0.1092000    
 C  -0.7954000       1.758900     -8.0000004E-03
 C   0.5766000     -0.3518000     -0.3051000    
 C  -0.6183000      -2.575500     -0.5746000    
 C   0.6634000      -1.871300     -0.1358000    
 C  -0.4496000      0.2127000       1.956300    
 C   -3.112800      -2.713400     -0.4972000    
 C    4.677900      0.7425000      0.2489000    
 C    3.202900      0.2587000      -2.371700    
 C    3.566400      -2.028900     -0.3936000    
 C    4.488300       2.266300      7.9200000E-02
 C    4.757500      0.4167000       1.757100    
 C    6.008200      0.3299000     -0.4193000    
 H   -3.724500     -0.4414000       1.188700    
 H   -1.951600     -0.3523000      -1.160500    
 H   -3.801000       1.985400       1.635300    
 H   -1.659700       2.779200       1.670100    
 H   -2.183700       3.415300      0.1292000    
 H  -0.8790000       1.824000      -1.097800    
 H   0.1223000       2.310800      0.2355000    
 H   0.4722000     -0.1281000      -1.377400    
 H  -0.7194000      -2.479900      -1.664200    
 H  -0.5138000      -3.646100     -0.3550000    
 H   0.9370000      -2.161000      0.8837000    
 H    1.371300      -2.304200     -0.8281000    
 H  -0.1270000     -0.7726000       2.301500    
 H   0.3225000      0.9231000       2.274700    
 H   -1.362000      0.4595000       2.507300    
 H   -3.231300      -2.469300      -1.557900    
 H   -3.027700      -3.802100     -0.4010000    
 H   -4.033700      -2.437400      2.6900001E-02
 H   -2.649200      -2.127200       1.916600    
 H    4.155100      2.3700001E-02  -2.855000    
 H    2.420400     -0.3093000      -2.883600    
 H    2.995200       1.323300      -2.511300    
 H    3.162800      -2.458400      0.5268000    
 H    3.234800      -2.591300      -1.271100    
 H    4.645100      -2.207500     -0.3484000    
 H    5.305900       2.815200      0.5619000    
 H    4.480200       2.565800     -0.9754000    
 H    3.552200       2.614900      0.5326000    
 H    4.920400     -0.6526000       1.938100    
 H    3.841400      0.7074000       2.285800    
 H    5.588900      0.9548000       2.228000    
 H    6.244200     -0.7294000     -0.2761000    
 H    6.016200      0.5357000      -1.495500    
 H    6.842500      0.8949000      1.5300000E-02


%chk=000178315-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000178315

0 1
Br -5.761299 1.541778 -0.118307
Br -3.417757 1.476226 -2.424562
Si 3.407463 -0.272638 -0.707221
O 1.915889 -0.306811 0.216630
O -2.152461 -2.345391 1.679391
C -3.048497 0.338182 0.422801
C -1.887192 -0.529870 -0.077667
C -2.842230 1.885520 0.564146
C -0.509529 0.071627 0.385359
C -3.798402 1.318535 -0.474662
C -1.471644 2.494372 0.249116
C -2.106553 -2.053240 0.220021
C -0.408259 1.485584 -0.263015
C 0.620046 -0.826637 -0.215017
C -0.895043 -2.863601 -0.296760
C 0.459608 -2.305261 0.188615
C -0.353373 0.172662 1.923995
C -3.413390 -2.557937 -0.430486
C 4.563683 0.830301 0.388301
C 3.064864 0.497131 -2.424989
C 4.103958 -2.040008 -0.930094
C 3.928150 2.237360 0.560767
C 4.727550 0.173164 1.787215
C 5.956236 0.969754 -0.287569
H -3.680970 -0.115879 1.196741
H -1.876291 -0.469749 -1.188565
H -3.359341 2.358739 1.407849
H -1.107690 2.954289 1.186248
H -1.589350 3.319804 -0.480083
H -0.496532 1.375197 -1.362701
H 0.598176 1.894645 -0.059554
H 0.541031 -0.757202 -1.329053
H -0.926187 -2.861807 -1.405358
H -1.018268 -3.910580 0.035160
H 0.537402 -2.400196 1.285438
H 1.286768 -2.895243 -0.249555
H -0.448621 -0.812457 2.406305
H 0.641038 0.590735 2.158191
H -1.124262 0.829670 2.364374
H -3.401650 -2.406892 -1.525300
H -3.538908 -3.635900 -0.225307
H -4.300990 -2.026847 -0.036968
H -2.992733 -1.978551 2.055504
H 4.002130 0.595464 -3.003870
H 2.375951 -0.132911 -3.018025
H 2.611995 1.500348 -2.331499
H 4.204304 -2.552313 0.043496
H 3.442188 -2.651790 -1.570891
H 5.100600 -2.013664 -1.409606
H 4.572445 2.866620 1.207909
H 3.814999 2.762270 -0.407296
H 2.931479 2.166843 1.033567
H 5.215325 -0.818369 1.722964
H 3.748726 0.041529 2.283110
H 5.360065 0.814415 2.434411
H 6.454886 -0.010147 -0.415726
H 5.889574 1.454220 -1.280952
H 6.617994 1.597509 0.342735


