%chk=000093911.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000093911

0 1
 Br   5.110600     -0.1187000     -0.3414000    
 O   -1.342300      0.5900000       1.623100    
 N   -3.806600     -0.2220000     -0.7476000    
 C   -1.058500      8.1600003E-02  0.3090000    
 C   -1.782000      -1.278600      0.1878000    
 C   -1.682400       1.055000     -0.7154000    
 C   -3.304000      -1.134500      0.2774000    
 C   -3.210400       1.105400     -0.6167000    
 C   0.4606000      3.1900000E-02  0.1503000    
 C    1.096500      -1.186000     -8.6400002E-02
 C    1.208500       1.205000      0.2408000    
 C    2.482800      -1.231100     -0.2329000    
 C    2.595000       1.160000      9.4400004E-02
 C    3.232200     -5.7999998E-02 -0.1425000    
 H   -1.464900      -1.952100      0.9944000    
 H   -1.539500      -1.761600     -0.7681000    
 H   -1.393400      0.7615000      -1.733700    
 H   -1.317600       2.077600     -0.5612000    
 H   -3.763700      -2.117300      0.1222000    
 H   -3.623800     -0.8074000       1.272900    
 H   -3.537600       1.578300      0.3161000    
 H   -3.596400       1.739400      -1.423400    
 H   -3.575000     -0.5985000      -1.667200    
 H   -2.295400      0.7252000       1.733000    
 H   0.5611000      -2.126000     -0.1598000    
 H   0.7354000       2.162500      0.4385000    
 H    2.964600      -2.188100     -0.4159000    
 H    3.164600       2.082700      0.1706000    


%chk=000093911-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000093911

0 1
Br 5.204029 -0.294575 -0.219475
O -1.332128 1.251881 1.316590
N -3.861386 -0.491706 -0.620085
C -1.082425 0.271205 0.230501
C -1.722312 -1.098492 0.618946
C -1.716742 0.797966 -1.092753
C -3.275125 -1.024149 0.631549
C -3.270526 0.806118 -1.021821
C 0.441449 0.152386 0.120138
C 1.023916 -0.695859 -0.856159
C 1.296856 0.867091 0.992914
C 2.425056 -0.832653 -0.965419
C 2.702170 0.741541 0.899944
C 3.249401 -0.108810 -0.080036
H -1.336833 -1.396669 1.612175
H -1.401560 -1.869421 -0.108393
H -1.397339 0.152691 -1.933711
H -1.329217 1.815709 -1.288125
H -3.698982 -2.025655 0.825389
H -3.614804 -0.379785 1.470079
H -3.611897 1.576618 -0.297526
H -3.690219 1.101935 -1.999849
H -3.831744 -1.180843 -1.383614
H -2.309506 1.375326 1.411765
H 0.391574 -1.265345 -1.547649
H 0.850943 1.522098 1.744608
H 2.862392 -1.489686 -1.722572
H 3.353357 1.297284 1.580889


