%chk=000063377.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000063377

0 1
 Br   6.164200     -0.5887000     -0.1084000    
 O  -0.2990000      -2.032700      0.1017000    
 N   0.1240000      0.2844000      6.3400000E-02
 N   -1.718400       1.786300     -3.9200000E-02
 C   -2.146200     -0.6186000      4.2199999E-02
 C  -0.4425000       1.560900      3.1599998E-02
 C  -0.6902000     -0.8678000      9.2299998E-02
 C    1.545700      7.8199998E-02  2.2900000E-02
 C   -2.597000      0.6984000     -4.6300001E-02
 C   -3.053300      -1.684800      5.7399999E-02
 C   -3.973800      0.9399000     -0.1195000    
 C   0.4386000       2.788600      0.1415000    
 C    2.189200     -2.5599999E-02  -1.203800    
 C    2.259800     -1.3700000E-02   1.211200    
 C   -4.422100      -1.430600     -1.5500000E-02
 C   -4.882700     -0.1192000     -0.1050000    
 C    3.569200     -0.2246000      -1.243000    
 C    3.639900     -0.2125000       1.171800    
 C    4.294600     -0.3181000     -5.5199999E-02
 H   -2.714900      -2.715100      0.1227000    
 H   -4.347900       1.958900     -0.1848000    
 H    1.146500       2.813800     -0.6914000    
 H   0.9965000       2.759100       1.081500    
 H  -0.1630000       3.701900      0.1174000    
 H    1.632000      4.6599999E-02  -2.133900    
 H    1.757700      6.7800000E-02   2.171400    
 H   -5.129000      -2.255000     -4.1000000E-03
 H   -5.948900      7.9899997E-02 -0.1618000    
 H    4.064100     -0.3047000      -2.207500    
 H    4.190100     -0.2830000       2.106500    


%chk=000063377-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000063377

0 1
Br 6.256187 -0.547930 0.020824
O -0.189370 -2.049088 0.020046
N 0.094000 0.286768 0.008119
N -1.765478 1.819571 0.000375
C -2.171408 -0.633428 0.005139
C -0.461508 1.591057 0.004537
C -0.722759 -0.903674 0.012176
C 1.536698 0.090186 0.010912
C -2.642988 0.718140 -0.000973
C -3.093469 -1.712840 0.004669
C -4.043930 0.964290 -0.007691
C 0.488758 2.764184 0.009940
C 2.236531 0.017467 -1.212496
C 2.222844 -0.045438 1.236669
C -4.473934 -1.454929 -0.002188
C -4.946954 -0.111551 -0.008350
C 3.636012 -0.171281 -1.216202
C 3.622152 -0.234919 1.246148
C 4.311484 -0.289798 0.016571
H -2.696549 -2.733273 0.009625
H -4.383508 2.004305 -0.011939
H 1.142089 2.766411 -0.880886
H 1.150824 2.749766 0.894294
H -0.112011 3.684368 0.020737
H 1.691039 0.093897 -2.158591
H 1.666828 -0.016965 2.179187
H -5.188158 -2.284938 -0.002834
H -6.024964 0.083777 -0.013442
H 4.184627 -0.230870 -2.160134
H 4.160113 -0.343265 2.191858


