%chk=000025567.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000025567

0 1
 Br  -4.921400     -0.2097000     -0.9667000    
 N   -1.190700      0.9031000      0.5944000    
 C  -0.3208000      0.3983000     -0.4609000    
 C    1.068800       1.017900     -0.4075000    
 C   1.3000000E-03  -1.079300     -0.2844000    
 C    2.050600      1.7800000E-02 -0.2241000    
 C    1.395100      -1.269600     -0.1486000    
 C   -2.532600      0.3299000      0.4747000    
 C  -0.6279000      0.6059000       1.912800    
 C    1.415000       2.357100     -0.4957000    
 C  -0.8786000      -2.148700     -0.2313000    
 C   -3.149900      0.6365000     -0.8895000    
 C    3.392100      0.3533000     -0.1397000    
 C    1.919500      -2.539500      2.9999999E-02
 C   -1.497400       1.156600       3.024200    
 C    2.767000       2.694500     -0.4108000    
 C  -0.3497000      -3.428100     -5.1700000E-02
 C    3.746000       1.702200     -0.2358000    
 C    1.035800      -3.621700      7.6399997E-02
 C   -3.322000       2.123700      -1.165800    
 H  -0.6768000      0.5858000      -1.478500    
 H   -3.183500      0.8530000       1.189200    
 H   -2.624600     -0.7109000      0.7857000    
 H  -0.4966000     -0.4644000       2.109300    
 H   0.3510000       1.082600       2.036000    
 H   0.6619000       3.125600     -0.6304000    
 H   -1.938400      -2.065100     -0.4247000    
 H   -2.632700      0.1473000      -1.718200    
 H    4.159300     -0.4009000      9.9999997E-05
 H    2.986700      -2.704800      0.1340000    
 H   -1.770500       2.202500       2.846200    
 H   -2.410000      0.5712000       3.174000    
 H  -0.9479000       1.122600       3.972000    
 H    3.067400       3.736600     -0.4800000    
 H   -1.013700      -4.288400     -3.3000000E-02
 H    4.792400       1.989000     -0.1718000    
 H    1.424900      -4.627700      0.2106000    
 H   -3.922000       2.611700     -0.3894000    
 H   -2.355200       2.634400      -1.216600    
 H   -3.827700       2.290000      -2.123700    


%chk=000025567-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000025567

0 1
Br -5.048920 0.737885 -1.665331
N -1.326725 0.530723 0.445073
C -0.302399 -0.048021 -0.460824
C 1.016355 0.735680 -0.476597
C 0.189788 -1.487990 -0.173709
C 2.125314 -0.138279 -0.289601
C 1.614895 -1.512577 -0.096093
C -2.729012 0.267104 0.054227
C -1.014800 0.416709 1.894759
C 1.207701 2.113854 -0.658885
C -0.549875 -2.673126 -0.012934
C -3.217952 1.354591 -0.932193
C 3.443561 0.367681 -0.301117
C 2.303102 -2.722388 0.137730
C -1.626132 1.550393 2.738335
C 2.530568 2.625126 -0.666755
C 0.139788 -3.888272 0.233135
C 3.637462 1.756434 -0.492924
C 1.554362 -3.911471 0.304478
C -3.370398 2.753816 -0.337554
H -0.737888 -0.024451 -1.482161
H -3.372069 0.288898 0.951884
H -2.864457 -0.730371 -0.414362
H -1.332147 -0.571123 2.304299
H 0.085641 0.458614 1.990284
H 0.346916 2.780570 -0.781899
H -1.643396 -2.673588 -0.076277
H -2.594508 1.364786 -1.842564
H 4.304907 -0.295368 -0.161991
H 3.397442 -2.747664 0.189507
H -1.248093 2.531327 2.400358
H -2.729542 1.567646 2.675141
H -1.355504 1.417556 3.802193
H 2.701052 3.698361 -0.807483
H -0.425563 -4.817756 0.363667
H 4.653459 2.167081 -0.503039
H 2.071405 -4.859850 0.488934
H -4.118111 2.762088 0.474736
H -2.393708 3.061510 0.080423
H -3.678321 3.484161 -1.104069


