REMARK  Name = BDB058355
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -4.099  -0.001   0.095  0.00  0.00    +0.135 A 
ATOM      2  C   LIG    1       -4.646  -0.608   1.233  0.00  0.00    +0.061 A 
ATOM      3 BR   LIG    1       -6.528  -0.654   1.523  0.00  0.00    -0.046 Br
ATOM      4  C   LIG    1       -3.839  -1.208   2.207  0.00  0.00    +0.045 A 
ATOM      5  C   LIG    1       -2.454  -1.182   2.008  0.00  0.00    +0.048 A 
ATOM      6  C   LIG    1       -1.858  -0.590   0.891  0.00  0.00    +0.014 A 
ATOM      7  C   LIG    1       -0.449  -0.764   1.043  0.00  0.00    +0.044 A 
ATOM      8  C   LIG    1       -0.232  -1.442   2.222  0.00  0.00    +0.095 A 
ATOM      9  N   LIG    1       -1.446  -1.690   2.796  0.00  0.00    -0.360 N 
ATOM     10  H   LIG    1       -1.590  -2.175   3.672  0.00  0.00    +0.165 HD
ATOM     11  C   LIG    1       -2.704   0.007  -0.074  0.00  0.00    +0.057 A 
ENDROOT
BRANCH   7  12
ATOM     12  C   LIG    1        0.728  -0.324   0.132  0.00  0.00    +0.158 A 
ATOM     13  O   LIG    1        2.049  -0.565   0.413  0.00  0.00    -0.434 OA
ATOM     14  C   LIG    1        2.742  -0.018  -0.634  0.00  0.00    +0.244 A 
ATOM     15  N   LIG    1        1.970   0.544  -1.546  0.00  0.00    -0.216 NA
ATOM     16  C   LIG    1        0.697   0.353  -1.065  0.00  0.00    +0.161 A 
BRANCH  14  17
ATOM     17  C   LIG    1        4.163  -0.049  -0.738  0.00  0.00    +0.102 A 
ATOM     18  N   LIG    1        4.822   0.511  -1.804  0.00  0.00    -0.357 N 
ATOM     19  H   LIG    1        4.357   0.975  -2.575  0.00  0.00    +0.165 HD
ATOM     20  C   LIG    1        6.174   0.342  -1.655  0.00  0.00    +0.083 A 
ATOM     21  C   LIG    1        6.386  -0.336  -0.475  0.00  0.00    +0.020 A 
ATOM     22  C   LIG    1        5.117  -0.584   0.105  0.00  0.00    +0.032 A 
ENDBRANCH  14  17
ENDBRANCH   7  12
BRANCH   1  24
ATOM     23  C   LIG    1       -4.460   1.178  -1.956  0.00  0.00    +0.277 C 
ATOM     24  O   LIG    1       -4.985   0.555  -0.793  0.00  0.00    -0.494 OA
ENDBRANCH   1  24
TORSDOF 3