%chk=000080163.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000080163

0 1
 Br  -3.968600      0.9219000      0.1542000    
 O    2.182400       2.278600      0.1485000    
 O   4.5499999E-02   2.302500     -0.3536000    
 N  -5.6499999E-02 -0.4799000     -0.2205000    
 N    1.557700      -1.934300      0.2391000    
 N    1.099300       1.662500     -7.0100002E-02
 C   -1.369400      2.2700001E-02 -0.5588000    
 C   0.2869000      -1.794300     -6.6600002E-02
 C    1.066900      0.2657000      1.5000000E-03
 C   -2.203000      0.2967000      0.6793000    
 C    2.049600     -0.6538000      0.2837000    
 C  -0.6909000      -2.888400     -0.2367000    
 H   -1.865600     -0.7547000      -1.154200    
 H   -1.307400      0.8564000      -1.260600    
 H   -2.357900     -0.5998000       1.286000    
 H   -1.770800       1.077600       1.310900    
 H    3.088200     -0.4658000      0.5167000    
 H   -1.558800      -2.756900      0.4159000    
 H   -1.031700      -2.952300      -1.274600    
 H  -0.2318000      -3.849400      1.8500000E-02


%chk=000080163-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000080163

0 1
Br -4.139594 0.835213 0.174409
O 2.326289 2.213587 0.186030
O 0.072206 2.384659 -0.199713
N -0.099538 -0.488573 -0.237488
N 1.589687 -1.949719 0.227926
N 1.158956 1.689371 -0.002984
C -1.462590 -0.012196 -0.580250
C 0.269038 -1.827269 -0.095033
C 1.069598 0.262874 0.016786
C -2.225626 0.432416 0.680053
C 2.090082 -0.660856 0.294461
C -0.659394 -2.983603 -0.292763
H -1.989734 -0.845343 -1.072254
H -1.390321 0.828936 -1.284549
H -2.279860 -0.356229 1.445638
H -1.822409 1.368551 1.090273
H 3.126762 -0.445223 0.537751
H -1.560003 -2.917325 0.344331
H -0.995943 -3.072036 -1.342855
H -0.113506 -3.902236 -0.031170


