%chk=000037231.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000037231

0 1
 Br   5.776100      0.2875000      0.5498000    
 O  -0.1549000     -0.1385000     -0.1938000    
 O   -2.670200      0.3741000     -0.4590000    
 O    4.123800      -2.313400      0.1600000    
 O   -2.384700       2.640700     -0.2584000    
 N   -4.494100      -1.635100      0.3561000    
 C    1.718400       1.084400      0.1193000    
 C   0.6066000       1.964500      5.0000001E-02
 C    1.197500     -0.1960000     -3.6300000E-02
 C  -0.5028000       1.173600     -0.1405000    
 C   -4.748300     -0.7798000     -0.7936000    
 C    3.105600       1.227900      0.2966000    
 C   -4.079900      0.5738000     -0.6138000    
 C    1.965900      -1.358700     -2.9300001E-02
 C   0.6356000       3.435900      0.1610000    
 C   -1.882500       1.496500     -0.2819000    
 C    3.342700      -1.192600      0.1480000    
 C    3.904700      7.6499999E-02  0.3087000    
 C   -5.102400      -2.954100      0.1656000    
 C   -5.001100      -1.017500       1.583900    
 C    4.643900      -2.749700      -1.092300    
 H   -5.822500     -0.6397000     -0.9675000    
 H   -4.325700      -1.254600      -1.688200    
 H    3.543000       2.214500      0.4212000    
 H   -4.484400       1.150600      0.2241000    
 H   -4.242100       1.162900      -1.524900    
 H    1.515800      -2.336900     -0.1539000    
 H   0.2389000       3.898600     -0.7486000    
 H   2.9899999E-02   3.770100       1.009900    
 H    1.651000       3.815900      0.3095000    
 H   -4.704300      -3.434800     -0.7351000    
 H   -6.193100      -2.896600      7.3299997E-02
 H   -4.860200      -3.615300       1.005000    
 H   -4.933700      -1.723600       2.420700    
 H   -6.048800     -0.7079000       1.494600    
 H   -4.395600     -0.1593000       1.891100    
 H    5.148000      -1.937000      -1.624400    
 H    3.837500      -3.153600      -1.712600    
 H    5.369400      -3.545700     -0.9035000    


%chk=000037231-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000037231

0 1
Br 5.573613 -0.044702 1.311634
O -0.074756 -0.543605 -0.979213
O -2.642238 -0.034026 -1.494306
O 4.488769 -2.315638 -0.619977
O -2.696977 1.872263 -0.126623
N -4.590646 -0.855806 0.655714
C 1.514883 0.562182 0.294518
C 0.270181 1.305458 0.407408
C 1.259930 -0.550906 -0.556623
C -0.658134 0.611546 -0.368655
C -4.773546 -1.062856 -0.791331
C 2.810907 0.726526 0.845329
C -4.117592 0.022633 -1.659228
C 2.228083 -1.502390 -0.899467
C 0.059993 2.558560 1.208935
C -2.078791 0.889744 -0.619715
C 3.521123 -1.330848 -0.354141
C 3.792945 -0.221305 0.514043
C -4.795505 -2.091865 1.436063
C -5.341195 0.294145 1.197495
C 5.446866 -1.988825 -1.699803
H -5.857056 -1.111721 -1.088083
H -4.319878 -2.034467 -1.060230
H 3.043086 1.558070 1.516108
H -4.472334 1.038007 -1.412899
H -4.292918 -0.190124 -2.726703
H 2.017836 -2.359627 -1.543046
H -0.977635 2.912036 1.120120
H 0.282688 2.378640 2.277856
H 0.740203 3.360759 0.864862
H -4.127825 -2.886780 1.058725
H -5.847234 -2.475478 1.402390
H -4.538084 -1.905526 2.493952
H -5.139239 0.381227 2.279500
H -6.448621 0.200302 1.057531
H -4.997036 1.229970 0.726223
H 6.035461 -1.087119 -1.449522
H 4.911595 -1.838909 -2.657245
H 6.112077 -2.861947 -1.770796


