REMARK  Name = BDB050074
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.533  -0.926  -0.505  0.00  0.00    +0.093 A 
ATOM      2  N   LIG    1        1.640  -0.221  -0.037  0.00  0.00    -0.211 N 
ATOM      3  C   LIG    1        2.772  -0.944  -0.392  0.00  0.00    +0.155 A 
ATOM      4  C   LIG    1        4.032  -0.424  -0.023  0.00  0.00    +0.051 A 
ATOM      5  C   LIG    1        4.093   0.732   0.646  0.00  0.00    +0.045 A 
ATOM      6  C   LIG    1        2.807   1.400   0.961  0.00  0.00    +0.150 A 
ATOM      7 CL   LIG    1        2.834   2.895   1.825  0.00  0.00    -0.060 Cl
ATOM      8  N   LIG    1        2.471  -2.041  -1.042  0.00  0.00    -0.234 NA
ATOM      9  N   LIG    1        1.629   0.965   0.646  0.00  0.00    -0.153 NA
ATOM     10  C   LIG    1        1.106  -2.038  -1.115  0.00  0.00    +0.141 A 
ENDROOT
BRANCH   1  13
ATOM     11  C   LIG    1       -2.708   0.896   0.369  0.00  0.00    +0.015 A 
ATOM     12  C   LIG    1       -1.341   0.600   0.273  0.00  0.00    +0.021 A 
ATOM     13  C   LIG    1       -0.896  -0.563  -0.374  0.00  0.00    +0.003 A 
ATOM     14  C   LIG    1       -1.882  -1.411  -0.917  0.00  0.00    +0.010 A 
ATOM     15  C   LIG    1       -3.247  -1.116  -0.822  0.00  0.00    +0.001 A 
ATOM     16  C   LIG    1       -3.663   0.042  -0.177  0.00  0.00    +0.011 A 
BRANCH  11  18
ATOM     17  O   LIG    1       -4.309   2.445   1.174  0.00  0.00    -0.296 OA
ATOM     18  C   LIG    1       -3.130   2.133   1.059  0.00  0.00    +0.258 C 
ENDBRANCH  11  18
ENDBRANCH   1  13
TORSDOF 2