%chk=000102480.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000102480

0 1
 Br   5.535200       2.469800      0.2546000    
 O    4.199500      -1.225500      0.3408000    
 O   -5.671000     -0.6394000      6.3000001E-02
 O    5.046000      4.9000001E-03  -1.415400    
 O   -4.927400       1.495300     -0.3986000    
 C   0.2731000       1.216500      9.7400002E-02
 C    1.669700      0.6597000      0.3966000    
 C  -0.8393000      0.1728000      0.2270000    
 C    2.792800       1.683500      0.1943000    
 C   -2.233400      0.7332000     -7.2200000E-02
 C    4.158800       1.111400      0.5603000    
 C   -3.355300     -0.2856000      0.1265000    
 C    4.542300     -6.9399998E-02 -0.3019000    
 C   -4.719300      0.3268000     -0.1021000    
 C    4.466300      -2.433500     -0.3789000    
 C   -7.022900     -0.2137000     -0.1360000    
 C    4.032900      -3.614800      0.4627000    
 C   -7.948100      -1.391800      8.2000002E-02
 H   6.7500003E-02   2.052200      0.7775000    
 H   0.2609000       1.626200     -0.9202000    
 H    1.835000     -0.2046000     -0.2569000    
 H    1.694000      0.2908000       1.429400    
 H  -0.6349000     -0.6629000     -0.4535000    
 H  -0.8269000     -0.2368000       1.244700    
 H    2.587300       2.572000      0.8044000    
 H    2.784700       2.012200     -0.8533000    
 H   -2.259300       1.108900      -1.103000    
 H   -2.413900       1.600300      0.5762000    
 H    4.237500      0.8589000       1.622100    
 H   -3.324300     -0.6737000       1.150700    
 H   -3.225300      -1.116300     -0.5757000    
 H    3.908600      -2.426700      -1.322100    
 H    5.539000      -2.503200     -0.5906000    
 H   -7.139800      0.1647000      -1.157600    
 H   -7.263500      0.5828000      0.5769000    
 H    4.222100      -4.557200     -5.8899999E-02
 H    4.568800      -3.625100       1.417500    
 H    2.965600      -3.548900      0.6981000    
 H   -8.992400      -1.101100     -6.2500000E-02
 H   -7.707900      -2.204100     -0.6119000    
 H   -7.829500      -1.792900       1.094100    


%chk=000102480-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000102480

0 1
Br 5.369270 1.998298 0.544912
O 5.015805 -1.453051 0.405072
O -6.186121 -0.295706 -0.018941
O 3.966385 -0.625055 -1.508628
O -5.286539 1.813400 -0.435494
C -0.023493 1.041508 0.096129
C 1.313679 0.331150 0.408658
C -1.249306 0.112635 0.243853
C 2.523718 1.285192 0.226851
C -2.582653 0.838284 -0.040315
C 3.841333 0.620683 0.626108
C -3.797971 -0.096988 0.106262
C 4.261452 -0.519763 -0.296511
C -5.122870 0.604896 -0.149300
C 5.561937 -2.597288 -0.394746
C -7.554933 0.266870 -0.240601
C 6.387237 -3.448168 0.563591
C -8.541175 -0.876043 -0.023337
H -0.141967 1.915065 0.769973
H 0.009531 1.444423 -0.936763
H 1.428197 -0.545105 -0.258922
H 1.288709 -0.052811 1.449899
H -1.139352 -0.749928 -0.446074
H -1.267993 -0.308518 1.271270
H 2.378639 2.187792 0.848586
H 2.587480 1.608289 -0.827943
H -2.568874 1.264722 -1.061642
H -2.696768 1.698242 0.646963
H 3.866506 0.289916 1.675804
H -3.836752 -0.539285 1.121488
H -3.724315 -0.956138 -0.588930
H 4.710113 -3.148757 -0.832245
H 6.163960 -2.177595 -1.220812
H -7.599516 0.677325 -1.265796
H -7.707445 1.100731 0.468476
H 6.821226 -4.307140 0.020225
H 7.211997 -2.859824 0.999975
H 5.762705 -3.837091 1.385856
H -9.574234 -0.514076 -0.176965
H -8.352653 -1.699952 -0.732708
H -8.461747 -1.275437 1.002222


