REMARK  Name = BDB017165
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        6.052   0.345  -1.393  0.00  0.00    +0.121 A 
ATOM      2  C   LIG    1        4.775   0.531  -1.931  0.00  0.00    +0.054 A 
ATOM      3  C   LIG    1        3.620   0.297  -1.167  0.00  0.00    -0.014 A 
ATOM      4  C   LIG    1        3.754  -0.135   0.169  0.00  0.00    -0.017 A 
ATOM      5  C   LIG    1        2.600  -0.370   0.935  0.00  0.00    +0.020 A 
ATOM      6  C   LIG    1        1.317  -0.187   0.395  0.00  0.00    +0.018 A 
ATOM      7  C   LIG    1        1.194   0.246  -0.928  0.00  0.00    +0.012 A 
ATOM      8  C   LIG    1        5.039  -0.319   0.702  0.00  0.00    +0.012 A 
ATOM      9  C   LIG    1        2.336   0.484  -1.701  0.00  0.00    +0.009 A 
ATOM     10  C   LIG    1        6.180  -0.082  -0.073  0.00  0.00    +0.046 A 
ENDROOT
BRANCH   1  12
ATOM     11  C   LIG    1        8.400   0.440  -1.756  0.00  0.00    +0.277 C 
ATOM     12  O   LIG    1        7.080   0.612  -2.255  0.00  0.00    -0.495 OA
ENDBRANCH   1  12
BRANCH   6  13
ATOM     13  C   LIG    1        0.137  -0.460   1.277  0.00  0.00    +0.167 C 
ATOM     14  O   LIG    1        0.335  -0.669   2.474  0.00  0.00    -0.292 OA
BRANCH  13  15
ATOM     15  C   LIG    1       -1.268  -0.491   0.678  0.00  0.00    +0.074 C 
ATOM     16  C   LIG    1       -2.325  -0.408   1.792  0.00  0.00    +0.095 C 
ATOM     17  N   LIG    1       -3.713  -0.383   1.292  0.00  0.00    -0.301 NA
ATOM     18  C   LIG    1       -3.897  -1.122   0.035  0.00  0.00    +0.084 C 
ATOM     19  C   LIG    1       -2.909  -2.278  -0.107  0.00  0.00    +0.016 C 
ATOM     20  C   LIG    1       -1.470  -1.764  -0.159  0.00  0.00    +0.014 C 
BRANCH  17  21
ATOM     21  C   LIG    1       -4.245   0.983   1.222  0.00  0.00    +0.088 C 
BRANCH  21  22
ATOM     22  C   LIG    1       -5.734   0.968   1.033  0.00  0.00    +0.003 C 
ATOM     23  C   LIG    1       -6.456   2.246   0.684  0.00  0.00    +0.005 C 
ATOM     24  C   LIG    1       -6.356   1.143  -0.331  0.00  0.00    +0.005 C 
ENDBRANCH  21  22
ENDBRANCH  17  21
ENDBRANCH  13  15
ENDBRANCH   6  13
TORSDOF 5