REMARK  Name = BDB016559
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        5.130   0.652   0.382  0.00  0.00    +0.170 C 
ATOM      2  N   LIG    1        3.674   0.618   0.495  0.00  0.00    -0.296 N 
ATOM      3  N   LIG    1        2.979   0.060  -0.569  0.00  0.00    -0.303 N 
ATOM      4  H   LIG    1        3.218   0.411  -1.498  0.00  0.00    +0.186 HD
ATOM      5  C   LIG    1        1.628  -0.238  -0.433  0.00  0.00    +0.125 A 
ATOM      6  C   LIG    1        0.956  -0.159   0.739  0.00  0.00    +0.065 A 
ATOM      7  C   LIG    1        1.752   0.291   1.902  0.00  0.00    +0.081 A 
ATOM      8 CL   LIG    1        1.022   0.369   3.468  0.00  0.00    -0.080 Cl
ATOM      9  C   LIG    1        3.042   0.648   1.738  0.00  0.00    +0.126 A 
ENDROOT
BRANCH   6  10
ATOM     10  N   LIG    1       -0.390  -0.455   0.920  0.00  0.00    -0.336 N 
ATOM     11  H   LIG    1       -0.722  -0.160   1.838  0.00  0.00    +0.147 HD
BRANCH  10  12
ATOM     12  C   LIG    1       -1.414  -0.507  -0.117  0.00  0.00    +0.096 C 
ATOM     13  C   LIG    1       -1.827   0.902  -0.578  0.00  0.00    +0.182 C 
ATOM     14  O   LIG    1       -2.898   0.851  -1.526  0.00  0.00    -0.378 OA
ATOM     15  C   LIG    1       -4.072   0.254  -0.977  0.00  0.00    +0.160 C 
ATOM     16  C   LIG    1       -3.799  -1.186  -0.563  0.00  0.00    +0.030 C 
ATOM     17  C   LIG    1       -2.640  -1.252   0.427  0.00  0.00    +0.027 C 
ENDBRANCH  10  12
ENDBRANCH   6  10
TORSDOF 2