%chk=000099997.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000099997

0 1
 Br   4.375500      -1.422200      0.3685000    
 O  -0.9075000       1.352600     -0.3729000    
 C   -1.029400      -1.101000     -0.2138000    
 C   -1.806100      0.2188000     -0.5644000    
 C   -2.940500      0.2900000      0.4867000    
 C   -1.564200      -1.537500       1.170600    
 C   -2.302600     -0.3270000       1.731000    
 C   0.3604000     -0.5605000     -0.1238000    
 C   -1.146200      -2.242300      -1.224400    
 C   -2.345200      0.3298000      -1.991600    
 C   0.3419000      0.8201000     -0.2191000    
 C   -3.495700       1.681100      0.7632000    
 C    1.560500      -1.233100      5.3199999E-02
 C    1.495700       1.578300     -0.1398000    
 C    2.740500     -0.4888000      0.1287000    
 C    2.707900      0.9102000      3.3000000E-02
 C    3.954800       1.731400      0.1150000    
 H   -3.767800     -0.3592000      0.1674000    
 H  -0.7817000      -1.882100       1.855100    
 H   -2.284200      -2.358700       1.059900    
 H   -3.048700     -0.6179000       2.477100    
 H   -1.598900      0.3657000       2.207700    
 H  -0.5998000      -3.129300     -0.8828000    
 H   -2.190600      -2.538800      -1.369500    
 H  -0.7319000      -1.968000      -2.201000    
 H   -1.532600      0.2646000      -2.723800    
 H   -3.081900     -0.4478000      -2.214600    
 H   -2.819600       1.304000      -2.153800    
 H   -2.727600       2.360400       1.146900    
 H   -3.918300       2.122300     -0.1445000    
 H   -4.293300       1.629900       1.512100    
 H    1.572000      -2.315700      0.1363000    
 H    1.445600       2.660000     -0.2120000    
 H    4.645200       1.468700     -0.6933000    
 H    3.743600       2.802300      1.7899999E-02
 H    4.448100       1.590200       1.082300    


%chk=000099997-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000099997

0 1
Br 4.477466 -1.447099 0.352140
O -0.924909 1.362360 -0.373792
C -1.052385 -1.125242 -0.224981
C -1.895675 0.191962 -0.577215
C -2.989098 0.301307 0.522524
C -1.591143 -1.565961 1.187626
C -2.309051 -0.324552 1.764918
C 0.370029 -0.577945 -0.133716
C -1.169850 -2.277204 -1.247482
C -2.404063 0.329058 -2.012934
C 0.356457 0.830376 -0.204927
C -3.565974 1.711721 0.736026
C 1.593672 -1.246181 0.033479
C 1.527976 1.600871 -0.114495
C 2.773775 -0.472586 0.122741
C 2.780189 0.946670 0.054553
C 4.054239 1.761574 0.149340
H -3.811315 -0.378884 0.206691
H -0.775666 -1.938441 1.831807
H -2.320139 -2.390341 1.058288
H -3.033836 -0.580162 2.558144
H -1.580869 0.392581 2.190048
H -0.588372 -3.150582 -0.897672
H -2.219246 -2.605165 -1.361496
H -0.781221 -1.991586 -2.240454
H -1.571650 0.286710 -2.736575
H -3.121592 -0.473927 -2.259251
H -2.913227 1.299976 -2.141211
H -2.763283 2.420257 1.001393
H -4.068599 2.092275 -0.172131
H -4.311284 1.703655 1.552470
H 1.642736 -2.337635 0.094187
H 1.483633 2.692271 -0.175378
H 4.765295 1.489108 -0.652367
H 3.838602 2.839876 0.069646
H 4.575779 1.581387 1.107554


