%chk=000033758.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000033758

0 1
 Br   3.190000      -1.246400     -4.8900001E-02
 N   -2.080300     -0.9573000      0.1005000    
 N   -3.276300     -0.3273000     -0.1518000    
 C  -0.8527000     -0.2643000      5.8400001E-02
 C   0.3484000     -0.9728000      3.0700000E-02
 C  -0.8401000       1.130500      4.4500001E-02
 C    1.562200     -0.2868000     -1.1100000E-02
 C   0.3739000       1.816600      2.9000000E-03
 C    1.574900       1.107900     -2.5100000E-02
 H   0.3348000      -2.060600      4.1800000E-02
 H   -1.754800       1.716400      7.2400004E-02
 H   0.3842000       2.902600     -6.2000002E-03
 H    2.512000       1.657800     -5.7100002E-02
 H   -2.053800      -1.969500      5.1800001E-02
 H   -4.022200     -0.8531000      0.3016000    
 H   -3.465800     -0.3764000      -1.152100    


%chk=000033758-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000033758

0 1
Br 3.278480 -1.257958 0.094989
N -2.057202 -1.039685 -0.106764
N -3.303200 -0.426303 -0.168161
C -0.863356 -0.299075 -0.058021
C 0.377240 -1.002012 -0.013965
C -0.862567 1.122823 -0.050374
C 1.572472 -0.266486 0.035724
C 0.360492 1.820432 0.000472
C 1.603577 1.142872 0.044417
H 0.396337 -2.097345 -0.018492
H -1.821446 1.646283 -0.084454
H 0.354364 2.916375 0.006209
H 2.549041 1.688769 0.083323
H -1.992767 -2.061551 -0.120685
H -3.874292 -0.442591 0.677056
H -3.782773 -0.427248 -1.068974


