REMARK  Name = BDB017205
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        6.546  -0.684  -0.048  0.00  0.00    +0.215 A 
ATOM      2  N   LIG    1        6.224  -1.448  -1.111  0.00  0.00    -0.221 NA
ATOM      3  C   LIG    1        4.910  -1.530  -1.419  0.00  0.00    +0.123 A 
ATOM      4  C   LIG    1        3.889  -0.884  -0.718  0.00  0.00    +0.001 A 
ATOM      5  C   LIG    1        4.262  -0.094   0.385  0.00  0.00    -0.011 A 
ATOM      6  C   LIG    1        3.267   0.573   1.115  0.00  0.00    +0.009 A 
ATOM      7  C   LIG    1        1.917   0.459   0.759  0.00  0.00    +0.012 A 
ATOM      8  C   LIG    1        1.539  -0.326  -0.335  0.00  0.00    +0.018 A 
ATOM      9  C   LIG    1        2.531  -0.993  -1.070  0.00  0.00    +0.021 A 
ATOM     10  C   LIG    1        5.618   0.002   0.720  0.00  0.00    +0.075 A 
ENDROOT
BRANCH   1  12
ATOM     11  C   LIG    1        8.763  -1.279  -0.499  0.00  0.00    +0.279 C 
ATOM     12  O   LIG    1        7.867  -0.549   0.333  0.00  0.00    -0.480 OA
ENDBRANCH   1  12
BRANCH   8  13
ATOM     13  C   LIG    1        0.113  -0.489  -0.768  0.00  0.00    +0.167 C 
ATOM     14  O   LIG    1       -0.118  -1.135  -1.790  0.00  0.00    -0.292 OA
BRANCH  13  15
ATOM     15  C   LIG    1       -1.006   0.153   0.049  0.00  0.00    +0.074 C 
ATOM     16  C   LIG    1       -2.331  -0.598  -0.186  0.00  0.00    +0.095 C 
ATOM     17  N   LIG    1       -3.437   0.185   0.380  0.00  0.00    -0.301 NA
ATOM     18  C   LIG    1       -3.647   1.430  -0.381  0.00  0.00    +0.084 C 
ATOM     19  C   LIG    1       -2.381   1.961  -1.070  0.00  0.00    +0.016 C 
ATOM     20  C   LIG    1       -1.123   1.654  -0.267  0.00  0.00    +0.014 C 
BRANCH  17  21
ATOM     21  C   LIG    1       -4.662  -0.617   0.473  0.00  0.00    +0.088 C 
BRANCH  21  22
ATOM     22  C   LIG    1       -5.682   0.083   1.325  0.00  0.00    +0.003 C 
ATOM     23  C   LIG    1       -6.795   0.896   0.711  0.00  0.00    +0.005 C 
ATOM     24  C   LIG    1       -7.102  -0.424   1.358  0.00  0.00    +0.005 C 
ENDBRANCH  21  22
ENDBRANCH  17  21
ENDBRANCH  13  15
ENDBRANCH   8  13
TORSDOF 5