%chk=000022354.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000022354

0 1
 Br -0.7306000      -2.734900     -0.3613000    
 N   0.5096000      9.6900001E-02 -0.9535000    
 N    1.275800      0.1591000      3.2699998E-02
 N    3.777400       2.366900      0.4178000    
 N    3.726000      -2.027800      0.7355000    
 C   -3.476600      0.3053000      0.3233000    
 C  -0.8237000      0.1422000     -0.5240000    
 C   -2.856900     -0.9390000      0.2071000    
 C   -2.769800       1.468000      1.5900001E-02
 C   -1.530400      -1.020500     -0.2166000    
 C   -1.443400       1.386500     -0.4077000    
 C   -4.895000      0.3933000      0.7760000    
 C    2.681700      0.1138000     -0.3676000    
 C    3.292200       1.370800      7.2499998E-02
 C    3.263600      -1.080600      0.2498000    
 H   -3.413400      -1.841500      0.4499000    
 H   -3.240700       2.443400      0.1040000    
 H  -0.9025000       2.299000     -0.6452000    
 H   -5.473200     -0.4695000      0.4281000    
 H   -4.938800      0.4290000       1.869000    
 H   -5.384500       1.288300      0.3771000    
 H    2.790700      3.3599999E-02  -1.457800    


%chk=000022354-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000022354

0 1
Br -1.256544 -2.661202 -1.593779
N 0.563782 -0.396321 -0.424346
N 1.405655 0.483427 0.025645
N 3.887351 1.936331 -1.919930
N 4.209351 -0.340605 1.900236
C -3.597759 0.293967 0.337575
C -0.810046 -0.125721 -0.147485
C -3.153791 -0.850346 -0.370164
C -2.626897 1.229838 0.800897
C -1.780154 -1.058448 -0.610371
C -1.263292 1.025607 0.564895
C -5.072332 0.519577 0.599551
C 2.831897 0.049399 -0.353423
C 3.432358 1.096750 -1.207594
C 3.609127 -0.152609 0.888441
H -3.881384 -1.581491 -0.734560
H -2.958030 2.119366 1.348547
H -0.508886 1.737032 0.915926
H -5.694749 -0.278679 0.163495
H -5.278955 0.557945 1.685653
H -5.406732 1.484504 0.174903
H 2.787530 -0.906021 -0.919111


