%chk=000086996.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000086996

0 1
 Br   3.765100     -6.9999998E-04  -1.154700    
 N   -3.936100     -5.0000002E-04 -0.3478000    
 C    1.395900      3.9999999E-04  0.3741000    
 C   0.7047000       1.208300      0.2803000    
 C   0.7049000      -1.207600      0.2808000    
 C    2.873800     -9.9999997E-05  0.5745000    
 C  -0.6775000       1.208100      9.2699997E-02
 C  -0.6774000      -1.207800      9.3199998E-02
 C   -1.368600      9.9999997E-05 -8.9999998E-04
 C   -2.784700     -1.9999999E-04 -0.1922000    
 H    1.231500       2.156300      0.3508000    
 H    1.231700      -2.155600      0.3518000    
 H    3.217400     -0.8872000       1.115100    
 H    3.217900      0.8872000       1.114600    
 H   -1.202300       2.157900      2.1299999E-02
 H   -1.202000      -2.157700      2.2200000E-02


%chk=000086996-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000086996

0 1
Br 3.923109 -0.000360 -1.178942
N -4.018166 -0.000853 -0.346834
C 1.412754 0.000110 0.382407
C 0.698080 1.223531 0.283045
C 0.697968 -1.223292 0.283596
C 2.894474 0.000115 0.603923
C -0.695548 1.230808 0.093239
C -0.695655 -1.230512 0.093797
C -1.404193 0.000159 -0.001221
C -2.831347 0.000205 -0.190117
H 1.241312 2.173338 0.346819
H 1.241122 -2.173114 0.347793
H 3.258191 -0.905561 1.109745
H 3.258248 0.906009 1.109302
H -1.242923 2.175436 0.019131
H -1.243125 -2.175119 0.020118


