%chk=000133086.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000133086

0 1
 Br -0.1539000      -2.072100       1.647300    
 O   -2.011500       1.660800     -0.4950000    
 O   0.5111000       2.466200      0.4088000    
 O    2.580800      0.6815000     -0.1048000    
 O   -3.516500      -2.266500      0.8930000    
 O    4.103600      -2.559200     -0.2001000    
 O    2.308600      -1.732400      -1.332300    
 N   -2.369600      -1.143000     -0.7861000    
 C   -1.847700       2.849400      0.2662000    
 C  -0.4661000       3.417800      4.9999999E-03
 C   -3.285500       1.070200     -0.2722000    
 C   -3.408800     -0.1920000      -1.105900    
 C    1.829000       2.938200      0.1658000    
 C    2.822700       1.884300      0.6150000    
 C   -2.515600      -2.108200      0.1965000    
 C    3.500300     -0.3379000      0.2610000    
 C   -1.291500      -2.968100      0.3584000    
 C    3.210700      -1.589100     -0.5208000    
 H   -2.612100       3.581400     -1.6700000E-02
 H   -1.951800       2.607900       1.330400    
 H  -0.3329000       4.348800      0.5667000    
 H  -0.3460000       3.618500      -1.065900    
 H   -4.074100       1.775800     -0.5570000    
 H   -3.393800      0.8304000      0.7923000    
 H   -4.389000     -0.6553000     -0.9543000    
 H   -3.292700      4.4700000E-02  -2.168700    
 H    1.947500       3.121200     -0.9085000    
 H    2.000500       3.871200      0.7138000    
 H    3.845000       2.232900      0.4314000    
 H    2.693100       1.686400       1.685400    
 H   -1.493400      -1.077600      -1.295900    
 H    4.520000     -1.1300000E-02  3.0900000E-02
 H    3.396000     -0.5620000       1.327900    
 H  -0.7308000      -3.078100     -0.5723000    
 H   -1.557300      -3.948700      0.7586000    
 H    3.937500      -3.388400     -0.6972000    


%chk=000133086-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000133086

0 1
Br -0.045612 -2.022499 2.364381
O -1.891326 1.856472 -0.631115
O 0.501109 2.889178 0.785524
O 2.340221 0.776067 -0.298722
O -3.336342 -2.389320 0.529957
O 3.377998 -2.583746 -0.938667
O 1.246280 -1.700370 -1.162919
N -1.724939 -1.173113 -0.643869
C -1.872009 2.951931 0.337624
C -0.553500 3.693122 0.161330
C -3.036662 0.955517 -0.472287
C -2.726584 -0.309297 -1.283743
C 1.828762 3.082607 0.209511
C 2.683504 1.886941 0.603749
C -2.118925 -2.148855 0.242167
C 3.005056 -0.454826 0.078146
C -0.993396 -2.991712 0.839062
C 2.416223 -1.590371 -0.740447
H -2.725259 3.646354 0.161472
H -1.943166 2.559047 1.374649
H -0.606969 4.695369 0.640581
H -0.358368 3.825302 -0.924020
H -3.963441 1.438252 -0.856103
H -3.190952 0.691979 0.594982
H -3.654047 -0.897581 -1.397548
H -2.359548 -0.011450 -2.281609
H 1.776144 3.140766 -0.898628
H 2.292626 4.019356 0.593120
H 3.763670 2.134935 0.504399
H 2.469738 1.609901 1.657925
H -0.724681 -0.996827 -0.803012
H 4.101211 -0.415497 -0.090433
H 2.828553 -0.703002 1.150524
H -0.197718 -3.217365 0.114095
H -1.415759 -3.893116 1.300485
H 2.973911 -3.356446 -1.419863


