%chk=000158251.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000158251

0 1
 Br   4.339800     -0.1555000     -0.5932000    
 O  -0.2006000       2.290700      0.2682000    
 O  -0.1644000      -2.486300      0.6809000    
 N   -3.952300      0.5379000      0.1660000    
 C   -1.669100     -7.8599997E-02  0.8255000    
 C   -2.555400      0.5272000     -0.2781000    
 C  -0.1997000     -9.7499996E-02  0.4787000    
 C   0.4552000       1.097400      0.2180000    
 C   0.4736000      -1.309500      0.4257000    
 C   -2.473600     -0.2539000      -1.589700    
 C    1.812700       1.080000     -0.1027000    
 C    1.831000      -1.327100      0.1052000    
 C    2.500700     -0.1322000     -0.1591000    
 C   0.5622000       3.461600     -1.6000001E-02
 C  -0.7600000      -3.154200     -0.4294000    
 H   -2.039000      -1.077900       1.082800    
 H   -1.780400      0.5079000       1.748800    
 H   -2.289200       1.565700     -0.4883000    
 H   -3.127200      0.1951000      -2.346900    
 H   -2.788700      -1.294400      -1.461000    
 H   -1.459100     -0.2481000      -1.999900    
 H   -4.026200       1.041700       1.049200    
 H   -4.261100     -0.4145000      0.3587000    
 H    2.384000       1.976900     -0.3176000    
 H    2.359100      -2.277000      6.4000003E-02
 H   0.9384000       3.459500      -1.044700    
 H    1.357700       3.615200      0.7213000    
 H  -0.1174000       4.316000      6.9799997E-02
 H   -1.840400      -3.209900     -0.2717000    
 H  -0.3627000      -4.172300     -0.4721000    
 H  -0.5530000      -2.656900      -1.383100    


%chk=000158251-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000158251

0 1
Br 4.225956 -0.312693 -1.170324
O -0.135880 2.367240 0.527548
O -0.586613 -2.366560 0.121411
N -4.113693 0.926050 0.160175
C -1.777335 0.122615 0.752076
C -2.754732 0.657621 -0.361676
C -0.335227 0.001942 0.304387
C 0.487527 1.155640 0.180153
C 0.254702 -1.250015 -0.021494
C -2.860287 -0.314033 -1.552177
C 1.837488 1.084902 -0.252706
C 1.602167 -1.361942 -0.456970
C 2.356909 -0.182649 -0.561903
C 0.661801 3.593733 0.455188
C -0.026091 -3.688647 -0.166391
H -2.144436 -0.861484 1.094237
H -1.832930 0.831809 1.599773
H -2.347731 1.621934 -0.720365
H -3.521306 0.111094 -2.326941
H -3.280351 -1.286135 -1.227288
H -1.868044 -0.510697 -1.993647
H -4.134175 1.616929 0.919506
H -4.619483 0.070467 0.421044
H 2.460987 1.975426 -0.346047
H 2.048862 -2.325974 -0.704894
H 1.003952 3.790420 -0.579249
H 1.535246 3.546831 1.134002
H -0.017291 4.396078 0.778803
H 0.295238 -3.769468 -1.222843
H -0.847380 -4.394737 0.024967
H 0.827046 -3.918697 0.500944


