%chk=000086865.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000086865

0 1
 Br   3.406900      -1.055300       1.467800    
 O    1.676100       1.609200      4.6000000E-02
 N   0.5368000     -0.4333000     -0.1935000    
 C  -0.8067000     -6.9399998E-02 -7.2499998E-02
 C   -1.816900      -1.028800     -0.1429000    
 C    2.959100     -0.3888000     -0.3134000    
 C   -1.132200       1.273100      0.1208000    
 C    1.668000      0.3949000     -0.1364000    
 C   -3.152400     -0.6457000     -2.0099999E-02
 C   -1.497700      -2.474000     -0.3488000    
 C   -2.467700       1.656200      0.2438000    
 C   -3.478000      0.6968000      0.1732000    
 C    4.104600      0.4650000     -0.8240000    
 H   0.7182000      -1.423300     -0.3343000    
 H    2.810200      -1.263300     -0.9534000    
 H  -0.4151000       2.078400      0.1838000    
 H   -3.952200      -1.379700     -7.2600000E-02
 H   -2.403700      -3.089500     -0.3785000    
 H  -0.9768000      -2.621800      -1.300700    
 H  -0.8782000      -2.852500      0.4711000    
 H   -2.722800       2.701400      0.3937000    
 H   -4.517800      0.9955000      0.2687000    
 H    3.864200      0.8789000      -1.809200    
 H    5.023000     -0.1243000     -0.9205000    
 H    4.320300       1.308000     -0.1575000    


%chk=000086865-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000086865

0 1
Br 2.963003 -2.287151 -0.993111
O 1.571558 1.702062 -1.060520
N 0.541318 -0.341560 -0.481120
C -0.813608 0.041994 -0.239426
C -1.733198 -0.994774 0.116530
C 2.988392 -0.214329 -1.023833
C -1.245028 1.389991 -0.344460
C 1.603663 0.447742 -0.855606
C -3.078648 -0.636189 0.360262
C -1.287458 -2.443871 0.229322
C -2.595736 1.711339 -0.094373
C -3.518883 0.703180 0.259227
C 3.992287 0.280874 0.027075
H 0.758156 -1.339648 -0.382958
H 3.339388 -0.000369 -2.045970
H -0.524934 2.162270 -0.620512
H -3.791397 -1.423494 0.632937
H -2.136239 -3.089066 0.508772
H -0.884283 -2.833834 -0.726777
H -0.505720 -2.584145 1.002687
H -2.922243 2.753664 -0.177611
H -4.567492 0.952508 0.453339
H 4.019686 1.384968 -0.016527
H 5.001346 -0.109963 -0.181189
H 3.695269 -0.024498 1.044441


