%chk=000090017.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000090017

0 1
 Br  -5.168900     -0.9575000      0.4462000    
 O  -0.7838000      -2.111400     -0.3658000    
 O    3.649800     -0.7215000      0.2871000    
 N   -1.469600      0.8001000     -0.3382000    
 N    1.999600      0.9115000      0.1325000    
 N    1.444000      -1.439700     -3.8800001E-02
 N   5.3900000E-02   2.405100     -6.7599997E-02
 C  -0.2674000      0.1669000     -0.2034000    
 C   0.6469000       1.171400     -3.9000001E-02
 C   5.1600002E-02  -1.223800     -0.2173000    
 C   -2.764600      0.1943000     -0.5363000    
 C    2.457700     -0.4299000      0.1384000    
 C   -1.224600       2.146100     -0.2495000    
 C    2.935700       2.015700      0.3037000    
 C   -3.455700     -9.9799998E-02  0.7823000    
 C    1.895400      -2.827300     -3.4400001E-02
 H   -2.641500     -0.7042000      -1.149200    
 H   -3.362200      0.8926000      -1.135900    
 H   -2.011300       2.884800     -0.3227000    
 H    3.960800       1.657600      0.4273000    
 H    2.652100       2.587700       1.192500    
 H    2.891000       2.660000     -0.5797000    
 H   -2.878600     -0.7874000       1.407400    
 H   -3.662700      0.8107000       1.352000    
 H    1.079000      -3.539700     -0.1714000    
 H    2.394400      -3.029000      0.9188000    
 H    2.627800      -2.958500     -0.8373000    


%chk=000090017-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000090017

0 1
Br -5.263356 -0.978056 0.452202
O -0.829683 -2.141053 -0.248094
O 3.638991 -0.741009 0.317428
N -1.521559 0.905252 -0.371732
N 2.008178 0.935227 0.117313
N 1.410046 -1.407291 0.024737
N 0.105902 2.500591 -0.138308
C -0.303089 0.223657 -0.197797
C 0.667150 1.231092 -0.062364
C 0.003016 -1.183412 -0.153884
C -2.858995 0.303346 -0.564000
C 2.429280 -0.416165 0.161593
C -1.217278 2.258672 -0.324040
C 3.002949 2.017635 0.256869
C -3.357458 -0.363913 0.729554
C 1.884514 -2.810097 0.082102
H -2.806268 -0.448775 -1.368201
H -3.546000 1.107949 -0.877175
H -1.974545 3.031400 -0.435814
H 3.989040 1.548292 0.383907
H 2.761340 2.641843 1.133151
H 2.996468 2.654891 -0.642992
H -2.782222 -1.272153 0.958972
H -3.387503 0.332686 1.580702
H 1.004102 -3.459715 -0.026604
H 2.389340 -2.998495 1.043457
H 2.606438 -2.997602 -0.729282


