REMARK  Name = BDB016564
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        3.167   0.986   0.914  0.00  0.00    -0.289 N 
ATOM      2  N   LIG    1        2.280   1.414  -0.066  0.00  0.00    -0.303 N 
ATOM      3  H   LIG    1        2.297   2.402  -0.315  0.00  0.00    +0.186 HD
ATOM      4  C   LIG    1        1.036   0.812  -0.188  0.00  0.00    +0.125 A 
ATOM      5  C   LIG    1        0.657  -0.277   0.520  0.00  0.00    +0.065 A 
ATOM      6  C   LIG    1        1.659  -0.797   1.479  0.00  0.00    +0.081 A 
ATOM      7 CL   LIG    1        1.305  -2.210   2.412  0.00  0.00    -0.080 Cl
ATOM      8  C   LIG    1        2.836  -0.161   1.637  0.00  0.00    +0.126 A 
ENDROOT
BRANCH   5   9
ATOM      9  N   LIG    1       -0.572  -0.921   0.421  0.00  0.00    -0.337 N 
ATOM     10  H   LIG    1       -0.703  -1.605   1.166  0.00  0.00    +0.146 HD
BRANCH   9  11
ATOM     11  C   LIG    1       -1.815  -0.380  -0.137  0.00  0.00    +0.084 C 
ATOM     12  C   LIG    1       -2.728  -1.570  -0.551  0.00  0.00    +0.106 C 
ATOM     13  N   LIG    1       -3.879  -1.294  -1.414  0.00  0.00    -0.304 NA
ATOM     14  C   LIG    1       -3.526  -0.662  -2.679  0.00  0.00    +0.104 C 
ATOM     15  C   LIG    1       -5.060  -0.708  -0.790  0.00  0.00    +0.084 C 
ATOM     16  C   LIG    1       -4.903   0.033   0.538  0.00  0.00    +0.015 C 
ATOM     17  C   LIG    1       -3.822   1.107   0.532  0.00  0.00    +0.003 C 
ATOM     18  C   LIG    1       -2.448   0.556   0.900  0.00  0.00    +0.023 C 
ENDBRANCH   9  11
ENDBRANCH   5   9
BRANCH   1  19
ATOM     19  C   LIG    1        4.503   1.593   0.958  0.00  0.00    +0.168 C 
BRANCH  19  22
ATOM     20  C   LIG    1        6.311  -0.560  -1.812  0.00  0.00    +0.035 C 
ATOM     21  C   LIG    1        5.264  -0.000  -0.906  0.00  0.00    -0.033 C 
ATOM     22  C   LIG    1        5.486   0.966   0.001  0.00  0.00    -0.008 C 
ENDBRANCH  19  22
ENDBRANCH   1  19
TORSDOF 4