REMARK  Name = BDB001809
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.631  -2.168   1.258  0.00  0.00    +0.219 A 
ATOM      2  N   LIG    1       -0.330  -1.292   0.779  0.00  0.00    -0.163 N 
ATOM      3  C   LIG    1       -1.727  -1.400   0.816  0.00  0.00    +0.283 C 
ATOM      4  O   LIG    1       -2.227  -2.329   1.453  0.00  0.00    -0.265 OA
ATOM      5  N   LIG    1        0.270  -0.172   0.291  0.00  0.00    -0.141 NA
ATOM      6  C   LIG    1        1.571  -0.436   0.482  0.00  0.00    +0.185 A 
ATOM      7  N   LIG    1        1.819  -1.645   1.090  0.00  0.00    -0.193 NA
ENDROOT
BRANCH   3   8
ATOM      8  C   LIG    1       -2.629  -0.417   0.186  0.00  0.00    +0.060 A 
ATOM      9  C   LIG    1       -2.649  -0.208  -1.196  0.00  0.00    +0.053 A 
ATOM     10 CL   LIG    1       -1.686  -1.133  -2.291  0.00  0.00    -0.083 Cl
ATOM     11  C   LIG    1       -3.516   0.747  -1.735  0.00  0.00    +0.021 A 
ATOM     12  C   LIG    1       -4.365   1.476  -0.899  0.00  0.00    +0.001 A 
ATOM     13  C   LIG    1       -4.361   1.248   0.476  0.00  0.00    +0.001 A 
ATOM     14  C   LIG    1       -3.498   0.297   1.022  0.00  0.00    +0.015 A 
ENDBRANCH   3   8
BRANCH   6  15
ATOM     15  C   LIG    1        2.644   0.469   0.101  0.00  0.00    +0.039 A 
ATOM     16  C   LIG    1        2.383   1.691  -0.511  0.00  0.00    +0.122 A 
ATOM     17  N   LIG    1        3.338   2.580  -0.888  0.00  0.00    -0.263 NA
ATOM     18  C   LIG    1        4.619   2.229  -0.645  0.00  0.00    +0.111 A 
ATOM     19  C   LIG    1        4.989   1.037  -0.043  0.00  0.00    +0.020 A 
ATOM     20  C   LIG    1        3.984   0.147   0.334  0.00  0.00    +0.014 A 
ENDBRANCH   6  15
BRANCH   1  21
ATOM     21  N   LIG    1        0.357  -3.369   1.803  0.00  0.00    -0.327 N 
ATOM     22  H   LIG    1        1.081  -3.814   2.357  0.00  0.00    +0.145 HD
ATOM     23  H   LIG    1       -0.596  -3.573   2.110  0.00  0.00    +0.145 HD
ENDBRANCH   1  21
TORSDOF 3