%chk=000062119.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000062119

0 1
 Br -4.2500000E-02  -1.701300       1.780400    
 Br  -2.187100       3.110000     -0.5084000    
 O  -0.1645000       1.276900      0.9491000    
 O   0.7495000      0.7251000      -1.131300    
 N   -5.727700      -2.072700     -0.8781000    
 C    3.680100      0.1251000      0.2008000    
 C    4.992700     -0.3043000     -0.4577000    
 C    3.340800       1.580800     -0.1352000    
 C    5.318300      -1.765000     -0.1473000    
 C    2.018700       2.029800      0.4865000    
 C    6.638500      -2.186400     -0.7725000    
 C   0.8264000       1.252800     -2.9999999E-02
 C   -1.317100      0.5839000      0.5723000    
 C   -1.415500     -0.7586000      0.8740000    
 C   -2.316800       1.264800     -9.0700001E-02
 C   -2.565800      -1.451200      0.4958000    
 C   -3.466900      0.5721000     -0.4690000    
 C   -3.591400     -0.7859000     -0.1757000    
 C   -4.769700      -1.495700     -0.5631000    
 H    3.758000      9.3000000E-03   1.288600    
 H    2.879300     -0.5421000     -0.1367000    
 H    4.922500     -0.1681000      -1.543700    
 H    5.807500      0.3388000     -0.1032000    
 H    3.294400       1.703400      -1.224200    
 H    4.142700       2.235300      0.2272000    
 H    4.518100      -2.413200     -0.5231000    
 H    5.372400      -1.912100      0.9376000    
 H    2.079900       1.910100       1.574500    
 H    1.844400       3.088800      0.2682000    
 H    6.608200      -2.080600      -1.861600    
 H    7.465200      -1.578900     -0.3908000    
 H    6.851200      -3.234300     -0.5387000    
 H   -2.665600      -2.511100      0.7225000    
 H   -4.269100       1.088400     -0.9931000    


%chk=000062119-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000062119

0 1
Br -0.049668 -1.952234 1.186137
Br -2.327066 3.214345 -0.188249
O -0.196788 1.157643 0.789586
O 0.725882 0.735690 -1.331851
N -6.209006 -1.878566 -0.579609
C 3.796504 0.110195 0.160780
C 5.162251 -0.310997 -0.426222
C 3.384668 1.544814 -0.239218
C 5.567899 -1.750750 -0.036045
C 2.034551 1.983434 0.374200
C 6.931116 -2.173266 -0.625190
C 0.858961 1.227139 -0.203934
C -1.404038 0.523973 0.448178
C -1.559832 -0.877244 0.597536
C -2.519411 1.290459 0.027297
C -2.789085 -1.505369 0.333917
C -3.760210 0.687057 -0.239880
C -3.894916 -0.719075 -0.087225
C -5.159746 -1.350027 -0.358679
H 3.833748 0.032907 1.267952
H 3.020530 -0.604299 -0.181289
H 5.127724 -0.229104 -1.532480
H 5.947266 0.395982 -0.084264
H 3.324376 1.618882 -1.341881
H 4.162755 2.260254 0.091484
H 4.781314 -2.453868 -0.378690
H 5.599430 -1.833350 1.069787
H 2.026192 1.867032 1.472051
H 1.850224 3.058239 0.170047
H 6.915416 -2.130666 -1.730632
H 7.739147 -1.503049 -0.275555
H 7.197405 -3.205135 -0.331146
H -2.896263 -2.586465 0.450631
H -4.612228 1.289319 -0.564142


