%chk=000125225.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000125225

0 1
 Br   2.902600       2.746800     -0.7750000    
 O   -1.195100      -1.444500      -1.784300    
 O   -3.120800       1.439500       1.289900    
 N   -2.379500      8.3200000E-02 -0.4662000    
 N   -3.273400      0.5035000      -1.422400    
 C  -0.6251000      -1.050800      0.5446000    
 C   -1.321400     -0.1487000       1.578400    
 C   0.8021000     -0.6670000      0.3449000    
 C   -1.417700     -0.8628000     -0.7316000    
 C   -2.392200      0.5819000      0.8124000    
 C    1.126900      0.6306000     -5.0600000E-02
 C    1.812400      -1.605600      0.5545000    
 C    2.461800      0.9896000     -0.2365000    
 C    3.147300      -1.246800      0.3687000    
 C    3.472000      5.0999999E-02 -2.6799999E-02
 H  -0.7192000      -2.099400      0.8523000    
 H  -0.6603000      0.5655000       2.078500    
 H   -1.812800     -0.7607000       2.343300    
 H   0.3460000       1.368300     -0.2185000    
 H    1.575200      -2.620400      0.8627000    
 H   -2.734000      0.8650000      -2.208200    
 H   -3.764500     -0.3206000      -1.766700    
 H    3.933900      -1.977700      0.5318000    
 H    4.517200      0.3142000     -0.1675000    


%chk=000125225-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000125225

0 1
Br 3.158391 2.832227 -0.540336
O -1.181086 -1.478163 -1.792067
O -3.433718 1.342077 1.224540
N -2.490778 0.015841 -0.516931
N -3.430575 0.332632 -1.514084
C -0.606147 -0.960779 0.604947
C -1.378035 -0.027184 1.583477
C 0.869182 -0.626171 0.394111
C -1.403559 -0.878287 -0.717499
C -2.564472 0.555023 0.807470
C 1.265605 0.702553 0.089714
C 1.854479 -1.638472 0.474725
C 2.627525 0.987968 -0.118740
C 3.216819 -1.331712 0.262371
C 3.619970 -0.010669 -0.036465
H -0.673121 -2.011624 0.940933
H -0.753709 0.800198 1.960943
H -1.762088 -0.565967 2.466221
H 0.522972 1.504200 0.011182
H 1.556052 -2.668952 0.698050
H -3.002410 0.833941 -2.300062
H -3.977034 -0.486424 -1.801869
H 3.973695 -2.120274 0.328167
H 4.673443 0.232119 -0.201096


