REMARK  Name = BDB057709
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1       -0.828   0.455  -1.388  0.00  0.00    -0.477 OA
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1        0.432   0.241  -0.905  0.00  0.00    +0.122 A 
ATOM      3  C   LIG    1        1.454   0.624  -1.775  0.00  0.00    +0.046 A 
ATOM      4  C   LIG    1        2.797   0.464  -1.419  0.00  0.00    +0.012 A 
ATOM      5  C   LIG    1        3.152  -0.086  -0.179  0.00  0.00    -0.018 A 
ATOM      6  C   LIG    1        2.115  -0.469   0.686  0.00  0.00    +0.012 A 
ATOM      7  C   LIG    1        0.768  -0.308   0.330  0.00  0.00    +0.046 A 
BRANCH   5   8
ATOM      8  C   LIG    1        4.563  -0.259   0.202  0.00  0.00    -0.018 A 
ATOM      9  C   LIG    1        5.460  -0.947  -0.634  0.00  0.00    +0.010 A 
ATOM     10  C   LIG    1        6.801  -1.112  -0.274  0.00  0.00    +0.020 A 
ATOM     11  C   LIG    1        7.263  -0.588   0.930  0.00  0.00    +0.041 A 
ATOM     12 CL   LIG    1        8.912  -0.790   1.375  0.00  0.00    -0.084 Cl
ATOM     13  C   LIG    1        6.396   0.098   1.775  0.00  0.00    +0.020 A 
ATOM     14  C   LIG    1        5.055   0.260   1.412  0.00  0.00    +0.010 A 
ENDBRANCH   5   8
ENDBRANCH   1   2
BRANCH   1  15
ATOM     15  C   LIG    1       -1.950   0.126  -0.564  0.00  0.00    +0.285 C 
BRANCH  15  17
ATOM     16  O   LIG    1       -2.211  -2.085   0.463  0.00  0.00    -0.247 OA
ATOM     17  C   LIG    1       -2.208  -1.378  -0.535  0.00  0.00    +0.346 C 
BRANCH  17  18
ATOM     18  O   LIG    1       -2.414  -1.929  -1.750  0.00  0.00    -0.478 OA
ATOM     19  H   LIG    1       -2.504  -2.887  -1.564  0.00  0.00    +0.295 HD
ENDBRANCH  17  18
ENDBRANCH  15  17
BRANCH  15  20
ATOM     20  C   LIG    1       -3.166   0.861  -1.150  0.00  0.00    +0.091 C 
BRANCH  20  21
ATOM     21  C   LIG    1       -4.385   0.815  -0.262  0.00  0.00    -0.043 A 
ATOM     22  C   LIG    1       -5.424  -0.087  -0.526  0.00  0.00    +0.004 A 
ATOM     23  C   LIG    1       -6.542  -0.141   0.307  0.00  0.00    +0.000 A 
ATOM     24  C   LIG    1       -6.631   0.704   1.411  0.00  0.00    +0.000 A 
ATOM     25  C   LIG    1       -5.604   1.605   1.683  0.00  0.00    +0.000 A 
ATOM     26  C   LIG    1       -4.485   1.661   0.851  0.00  0.00    +0.004 A 
ENDBRANCH  20  21
ENDBRANCH  15  20
ENDBRANCH   1  15
TORSDOF 7