%chk=000006438.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000006438

0 1
 Br  -3.062400     -0.8474000      0.1610000    
 O   -1.473400       1.948900      0.1927000    
 C    1.106200     -0.4214000      0.4903000    
 C   0.5477000      0.7001000     -0.4341000    
 C  -0.1567000      -1.317100      0.2699000    
 C   0.2381000     -3.3199999E-02  -1.758000    
 C  -0.1878000      -1.437600      -1.279600    
 C   -1.301100     -0.4111000      0.7809000    
 C  -0.8423000      0.9030000      0.1899000    
 C    2.425600      -1.062200      1.3100000E-02
 C    1.344500      1.4300000E-02   1.952100    
 C    1.361600       1.963500     -0.5782000    
 H  -0.1241000      -2.289500      0.7685000    
 H    1.111800     -9.4599999E-02  -2.415600    
 H  -0.5702000      0.4493000      -2.319900    
 H   -1.157300      -1.730000      -1.689200    
 H   0.5258000      -2.193500      -1.625700    
 H   -1.335400     -0.3523000       1.871000    
 H    3.265400     -0.3720000      0.1549000    
 H    2.438600      -1.343700      -1.041900    
 H    2.638100      -1.968400      0.5917000    
 H    2.265300      0.6032000       2.037100    
 H    1.449700     -0.8637000       2.599200    
 H   0.5500000      0.6391000       2.368600    
 H   0.8683000       2.671000      -1.253800    
 H    1.485100       2.470800      0.3844000    
 H    2.356600       1.753100     -0.9826000    


%chk=000006438-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000006438

0 1
Br -3.160621 -0.918631 0.156835
O -1.474054 2.028443 0.232672
C 1.116665 -0.428796 0.503168
C 0.568223 0.733507 -0.425142
C -0.145527 -1.362600 0.263419
C 0.237474 -0.045439 -1.761399
C -0.192291 -1.476148 -1.286441
C -1.280353 -0.422415 0.734744
C -0.830701 0.959080 0.185287
C 2.439091 -1.060137 0.011641
C 1.326624 0.005061 1.977932
C 1.394018 2.003541 -0.602093
H -0.123463 -2.325659 0.797900
H 1.142574 -0.070171 -2.394835
H -0.552856 0.464973 -2.338990
H -1.197703 -1.754018 -1.641247
H 0.507215 -2.252605 -1.639176
H -1.380390 -0.390006 1.831392
H 3.269675 -0.339013 0.123849
H 2.413072 -1.378013 -1.043117
H 2.686587 -1.947840 0.624068
H 2.250010 0.605725 2.068996
H 1.444200 -0.881404 2.629121
H 0.504477 0.619052 2.386692
H 0.834973 2.746719 -1.197881
H 1.624526 2.475751 0.369963
H 2.346256 1.789642 -1.120657


