REMARK  Name = BDB056151
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -0.429  -0.747  -0.575  0.00  0.00    -0.304 N 
ATOM      2  H   LIG    1       -0.034   0.152  -0.821  0.00  0.00    +0.150 HD
ATOM      3  C   LIG    1        0.445  -1.806  -0.431  0.00  0.00    +0.255 C 
ATOM      4  O   LIG    1        0.106  -2.982  -0.439  0.00  0.00    -0.269 OA
ENDROOT
BRANCH   3   5
ATOM      5  C   LIG    1        1.873  -1.411  -0.305  0.00  0.00    +0.115 C 
ATOM      6  C   LIG    1        2.189  -0.518   0.653  0.00  0.00    +0.051 C 
BRANCH   6   7
ATOM      7  C   LIG    1        3.525   0.009   0.944  0.00  0.00    +0.066 A 
ATOM      8  N   LIG    1        4.360   0.148  -0.103  0.00  0.00    -0.241 NA
ATOM      9  C   LIG    1        5.590   0.650   0.141  0.00  0.00    +0.107 A 
ATOM     10 BR   LIG    1        6.771   0.835  -1.330  0.00  0.00    -0.029 Br
ATOM     11  C   LIG    1        6.021   1.042   1.399  0.00  0.00    +0.035 A 
ATOM     12  C   LIG    1        5.138   0.912   2.465  0.00  0.00    +0.005 A 
ATOM     13  C   LIG    1        3.867   0.391   2.236  0.00  0.00    +0.028 A 
ENDBRANCH   6   7
BRANCH   5  14
ATOM     14  C   LIG    1        2.809  -2.095  -1.132  0.00  0.00    +0.104 C 
ATOM     15  N   LIG    1        3.556  -2.666  -1.814  0.00  0.00    -0.191 NA
ENDBRANCH   5  14
ENDBRANCH   3   5
BRANCH   1  16
ATOM     16  C   LIG    1       -1.829  -0.962  -0.915  0.00  0.00    +0.103 C 
BRANCH  16  17
ATOM     17  C   LIG    1       -2.467   0.306  -1.466  0.00  0.00    -0.027 A 
ATOM     18  C   LIG    1       -2.293   1.561  -0.859  0.00  0.00    +0.005 A 
ATOM     19  C   LIG    1       -2.896   2.703  -1.391  0.00  0.00    +0.000 A 
ATOM     20  C   LIG    1       -3.683   2.608  -2.535  0.00  0.00    +0.000 A 
ATOM     21  C   LIG    1       -3.872   1.372  -3.147  0.00  0.00    +0.000 A 
ATOM     22  C   LIG    1       -3.270   0.229  -2.616  0.00  0.00    +0.005 A 
ENDBRANCH  16  17
BRANCH  16  23
ATOM     23  C   LIG    1       -2.670  -1.616   0.206  0.00  0.00    +0.027 C 
BRANCH  23  25
ATOM     24  C   LIG    1       -1.661  -0.573   2.328  0.00  0.00    +0.004 C 
ATOM     25  C   LIG    1       -2.908  -0.824   1.498  0.00  0.00    -0.001 C 
ENDBRANCH  23  25
ENDBRANCH  16  23
ENDBRANCH   1  16
TORSDOF 7