%chk=000152920.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000152920

0 1
 Br  -5.019700       1.148500     -0.3758000    
 O   0.3756000      -1.939700      -1.620500    
 O    2.601700     -0.4320000      -1.847700    
 O    2.940200       2.014500     -0.5603000    
 O    3.591900       1.153700       1.964500    
 O  -0.8187000      -2.919400       1.424500    
 O   -2.430900       1.037000       1.427400    
 N   -1.430700      4.6100002E-02 -0.4212000    
 C   0.7552000      -1.138100     -0.4928000    
 C    1.544400      7.6499999E-02  -1.022600    
 C  -0.5120000     -0.7968000      0.3022000    
 C    2.145600      0.9976000      5.2299999E-02
 C    3.048000      0.2351000       1.021700    
 C   -1.279000      -2.046100      0.6932000    
 C   -2.321800      0.9008000      0.2102000    
 C   -3.189500       1.662400     -0.7550000    
 H    1.404700      -1.787000      0.1051000    
 H   0.9176000      0.6672000      -1.701100    
 H  -0.2434000     -0.2863000       1.234300    
 H    1.347900       1.505800      0.6053000    
 H    3.888900     -0.2316000      0.4988000    
 H    2.496700     -0.5258000       1.579900    
 H   -1.464700     -4.8900001E-02  -1.432000    
 H   -2.288700      -2.165400      0.2621000    
 H    1.188600      -2.164700      -2.104400    
 H    3.098600      0.3323000      -2.186300    
 H    3.297200       2.574300      0.1505000    
 H    4.162800      0.6428000       2.563500    
 H   -2.989800       1.424000      -1.801300    
 H   -3.092200       2.736600     -0.5847000    


%chk=000152920-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000152920

0 1
Br -3.758171 0.545331 -2.810073
O 0.063706 -1.557282 -1.663751
O 2.390254 -0.322977 -1.957411
O 3.366352 1.723769 -0.574365
O 4.164145 0.729785 1.732998
O -0.197482 -2.245540 2.026738
O -2.564854 1.411327 1.146891
N -1.684764 -0.017169 -0.463999
C 0.622909 -0.897172 -0.476776
C 1.517261 0.271150 -0.933001
C -0.586031 -0.462857 0.389293
C 2.388920 0.909690 0.171084
C 3.145869 -0.098042 1.054300
C -1.019785 -1.599003 1.341596
C -2.602210 0.893080 -0.017328
C -3.736768 1.336843 -0.938451
H 1.223508 -1.625904 0.101297
H 0.898719 1.069198 -1.394419
H -0.296302 0.376806 1.055539
H 1.773547 1.570458 0.814802
H 3.625225 -0.875512 0.426133
H 2.464643 -0.573054 1.787453
H -1.716933 -0.426726 -1.406896
H -2.118905 -1.788929 1.386687
H 0.795488 -1.585809 -2.338240
H 3.126845 0.333884 -2.098644
H 4.111626 1.910594 0.059537
H 4.719021 0.177736 2.334777
H -3.687631 2.427150 -1.075800
H -4.703703 1.062578 -0.490170


