REMARK  Name = BDB051871
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.233  -0.447  -0.171  0.00  0.00    +0.139 A 
ATOM      2  O   LIG    1        1.058   0.515   0.393  0.00  0.00    -0.455 OA
ATOM      3  C   LIG    1        2.416   0.337   0.315  0.00  0.00    +0.139 A 
ATOM      4  C   LIG    1        3.000  -0.759  -0.315  0.00  0.00    +0.064 A 
ATOM      5  C   LIG    1        4.391  -0.890  -0.366  0.00  0.00    +0.015 A 
ATOM      6  C   LIG    1        5.196   0.088   0.221  0.00  0.00    +0.001 A 
ATOM      7  C   LIG    1        4.612   1.187   0.853  0.00  0.00    +0.004 A 
ATOM      8  C   LIG    1        2.125  -1.771  -0.922  0.00  0.00    +0.193 A 
ATOM      9  O   LIG    1        2.563  -2.761  -1.493  0.00  0.00    -0.287 OA
ATOM     10  C   LIG    1        3.222   1.313   0.901  0.00  0.00    +0.047 A 
ATOM     11  C   LIG    1        0.676  -1.539  -0.811  0.00  0.00    +0.098 A 
ENDROOT
BRANCH   1  16
ATOM     12  C   LIG    1       -5.415   0.751   0.396  0.00  0.00    +0.044 C 
ATOM     13  C   LIG    1       -3.960   0.430   0.222  0.00  0.00    -0.050 A 
ATOM     14  C   LIG    1       -3.046   1.437  -0.105  0.00  0.00    +0.004 A 
ATOM     15  C   LIG    1       -1.685   1.144  -0.236  0.00  0.00    +0.012 A 
ATOM     16  C   LIG    1       -1.208  -0.160  -0.038  0.00  0.00    +0.017 A 
ATOM     17  C   LIG    1       -2.127  -1.159   0.315  0.00  0.00    +0.012 A 
ATOM     18  C   LIG    1       -3.488  -0.867   0.446  0.00  0.00    +0.004 A 
ENDBRANCH   1  16
TORSDOF 1