%chk=000096742.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000096742

0 1
 Br   7.959400     -8.7800004E-02 -0.8063000    
 O  -0.7624000       1.126300      -1.806400    
 O    1.690900     -0.8759000       1.766000    
 N  -0.1355000      0.6376000      0.3688000    
 N    1.201500      0.5997000      4.9500000E-02
 C   -3.296200     -0.1846000     -0.2184000    
 C   -4.643600     -6.7199998E-02  0.1981000    
 C   -2.473000      0.9532000     -0.2090000    
 C   -2.811700      -1.436400     -0.6318000    
 C   -5.128200       1.184400      0.6118000    
 C   -2.971200       2.189100      0.2047000    
 C   -5.467000      -1.204900      0.1890000    
 C   -4.296200       2.304500      0.6146000    
 C   -1.073800      0.9108000     -0.6242000    
 C   -3.644000      -2.556100     -0.6346000    
 C   -4.969000      -2.440600     -0.2252000    
 C    3.476300     -0.1667000      0.4178000    
 C    2.042900     -0.1902000      0.8093000    
 C    4.432900     -0.4254000       1.377200    
 C    3.803800      0.1146000     -0.8922000    
 C    5.778300     -0.4020000       1.009600    
 C    5.149300      0.1379000      -1.259600    
 C    6.136500     -0.1204000     -0.3088000    
 H   -1.783900      -1.570500     -0.9603000    
 H   -6.160600       1.297900      0.9362000    
 H   -2.335400       3.071000      0.2121000    
 H   -6.505900      -1.137900      0.5051000    
 H   -4.683500       3.266700      0.9368000    
 H   -3.257300      -3.518500     -0.9569000    
 H   -5.616400      -3.312800     -0.2277000    
 H  -0.3852000      0.4781000       1.339800    
 H    1.501200       1.224300     -0.6912000    
 H    4.170600     -0.6410000       2.408600    
 H    3.064600      0.2899000      -1.666900    
 H    6.535400     -0.6040000       1.763000    
 H    5.411700      0.3523000      -2.292500    


%chk=000096742-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000096742

0 1
Br 8.302229 -0.322778 -0.745711
O -0.708213 -0.416520 -1.556818
O 2.023478 1.058331 2.052891
N -0.014437 0.491772 0.429883
N 1.302094 0.280839 0.016600
C -3.529449 -0.442568 -0.313459
C -4.848159 -0.101201 0.190766
C -2.417658 0.419149 0.035194
C -3.392066 -1.625250 -1.116502
C -5.022972 1.072375 0.994491
C -2.639575 1.567638 0.817206
C -5.964165 -0.946337 -0.122060
C -3.939348 1.896531 1.299176
C -1.029991 0.124793 -0.440954
C -4.500005 -2.428078 -1.400070
C -5.797261 -2.090661 -0.902024
C 3.722886 0.358867 0.438804
C 2.318948 0.593211 0.897736
C 4.752415 0.579332 1.388742
C 4.071842 -0.059172 -0.872630
C 6.105626 0.381528 1.048903
C 5.422079 -0.261143 -1.227489
C 6.425019 -0.040259 -0.259176
H -2.409905 -1.872595 -1.525697
H -6.026989 1.317251 1.360703
H -1.810982 2.252445 1.030963
H -6.953517 -0.675846 0.265652
H -4.079194 2.801769 1.898597
H -4.375420 -3.324581 -2.017231
H -6.654516 -2.731143 -1.136029
H -0.094325 0.825343 1.396290
H 1.355991 -0.142369 -0.916370
H 4.467074 0.908123 2.392975
H 3.312170 -0.224144 -1.645033
H 6.894482 0.551833 1.786589
H 5.687113 -0.581083 -2.238911


