%chk=000030824.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000030824

0 1
 Br  -2.383300       3.492200       1.396200    
 Br  -2.331800      -3.501600      -1.406400    
 Br  -2.592500       3.865900      -1.973400    
 Br  -2.535500      -3.916300       1.958700    
 N  -0.4977000      9.1000004E-03  1.9800000E-02
 N    1.522000      0.9043000      0.8052000    
 N    1.511600     -0.8837000     -0.7948000    
 N    3.594800      1.2400000E-02 -1.0600000E-02
 N    3.573400       1.759900       1.552900    
 N    3.552900      -1.734100      -1.574700    
 C   -1.244700      0.9286000      0.8480000    
 C   -1.237500     -0.9251000     -0.8291000    
 C   -1.489600       2.264500      0.1445000    
 C   -1.459600      -2.272800     -0.1408000    
 C   0.9032000      9.8000001E-03  9.8000001E-03
 C   -2.313800       2.127500      -1.127200    
 C   -2.286400      -2.164000       1.132100    
 C    2.862100      0.8479000      0.7432000    
 C    2.852400     -0.8244000     -0.7533000    
 H   -2.221400      0.5025000       1.107200    
 H  -0.7465000       1.080200       1.814600    
 H  -0.7391000      -1.051800      -1.799100    
 H   -2.222600     -0.5119000      -1.076600    
 H  -0.5356000       2.757900     -7.4500002E-02
 H  -0.4975000      -2.752100      7.3500000E-02
 H   -3.311100       1.717000     -0.9442000    
 H   -1.802700       1.539700      -1.892800    
 H   -3.290500      -1.768800      0.9525000    
 H   -1.786700      -1.573200       1.903000    
 H    3.063500       2.408500       2.136700    
 H    4.583900       1.754400       1.538400    
 H    4.563500      -1.726400      -1.576000    
 H    3.035400      -2.383400      -2.150900    


%chk=000030824-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000030824

0 1
Br -2.332630 3.629762 1.531044
Br -2.309145 -3.645648 -1.521343
Br -1.782743 4.216385 -2.117445
Br -1.723072 -4.235735 2.122400
N -0.668593 -0.002441 0.004238
N 1.345934 0.981324 0.730557
N 1.348921 -0.968938 -0.736204
N 3.466560 0.014400 -0.009421
N 3.400193 1.864007 1.422049
N 3.405574 -1.835872 -1.440303
C -1.398736 0.983498 0.826834
C -1.395818 -0.992299 -0.816157
C -1.400144 2.403949 0.194806
C -1.378510 -2.414587 -0.188749
C 0.723205 0.003783 -0.000902
C -2.097337 2.465190 -1.157711
C -2.064818 -2.486324 1.168894
C 2.720478 0.924496 0.694383
C 2.723202 -0.901435 -0.708607
H -2.435914 0.631361 0.967349
H -0.916154 1.067675 1.814925
H -0.920929 -1.068616 -1.808662
H -2.437499 -0.649650 -0.946737
H -0.368592 2.784374 0.154520
H -0.342992 -2.784842 -0.157433
H -3.190597 2.363346 -1.082298
H -1.675365 1.704617 -1.835463
H -3.159702 -2.396788 1.101852
H -1.646373 -1.722128 1.844799
H 2.878924 2.554310 1.956425
H 4.416814 1.856336 1.411484
H 4.422153 -1.820410 -1.436083
H 2.886305 -2.530402 -1.971139


