REMARK  Name = BDB016571
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        0.854  -1.040   0.712  0.00  0.00    -0.337 N 
ATOM      2  H   LIG    1        0.857  -1.391   1.673  0.00  0.00    +0.146 HD
ENDROOT
BRANCH   1   3
ATOM      3  C   LIG    1        2.105  -0.541   0.346  0.00  0.00    +0.071 A 
ATOM      4  C   LIG    1        3.234  -0.634   1.066  0.00  0.00    +0.129 A 
ATOM      5 CL   LIG    1        3.229  -1.418   2.615  0.00  0.00    -0.076 Cl
ATOM      6  C   LIG    1        4.533  -0.065   0.604  0.00  0.00    +0.287 A 
ATOM      7  O   LIG    1        5.558  -0.191   1.273  0.00  0.00    -0.265 OA
ATOM      8  N   LIG    1        4.491   0.613  -0.610  0.00  0.00    -0.231 N 
ATOM      9  C   LIG    1        5.706   1.181  -1.166  0.00  0.00    +0.176 C 
ATOM     10  N   LIG    1        3.379   0.682  -1.409  0.00  0.00    -0.175 NA
ATOM     11  C   LIG    1        2.294   0.144  -0.958  0.00  0.00    +0.157 A 
ENDBRANCH   1   3
BRANCH   1  17
ATOM     12  C   LIG    1       -4.633   0.679   0.795  0.00  0.00    +0.024 C 
ATOM     13  C   LIG    1       -3.204   0.178   1.025  0.00  0.00    +0.053 C 
ATOM     14  N   LIG    1       -2.937  -1.130   0.392  0.00  0.00    -0.301 NA
ATOM     15  C   LIG    1       -3.239  -1.190  -1.038  0.00  0.00    +0.105 C 
ATOM     16  C   LIG    1       -1.557  -1.569   0.671  0.00  0.00    +0.106 C 
ATOM     17  C   LIG    1       -0.456  -0.553   0.272  0.00  0.00    +0.084 C 
ATOM     18  C   LIG    1       -0.749   0.809   0.909  0.00  0.00    +0.025 C 
ATOM     19  C   LIG    1       -2.182   1.258   0.627  0.00  0.00    +0.020 C 
ENDBRANCH   1  17
TORSDOF 2