REMARK  Name = BDB017274
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.187   0.733   1.081  0.00  0.00    +0.167 C 
ATOM      2  O   LIG    1        0.166   1.940   1.327  0.00  0.00    -0.292 OA
ENDROOT
BRANCH   1   9
ATOM      3  C   LIG    1        7.677  -1.161  -1.085  0.00  0.00    +0.044 C 
ATOM      4  C   LIG    1        6.338  -0.598  -0.710  0.00  0.00    -0.050 A 
ATOM      5  C   LIG    1        5.251  -1.450  -0.474  0.00  0.00    +0.012 A 
ATOM      6  C   LIG    1        3.998  -0.941  -0.091  0.00  0.00    -0.018 A 
ATOM      7  C   LIG    1        3.837   0.452   0.069  0.00  0.00    -0.017 A 
ATOM      8  C   LIG    1        2.584   0.961   0.451  0.00  0.00    +0.020 A 
ATOM      9  C   LIG    1        1.490   0.111   0.675  0.00  0.00    +0.018 A 
ATOM     10  C   LIG    1        1.660  -1.268   0.519  0.00  0.00    +0.012 A 
ATOM     11  C   LIG    1        4.933   1.298  -0.155  0.00  0.00    +0.009 A 
ATOM     12  C   LIG    1        2.902  -1.786   0.139  0.00  0.00    +0.009 A 
ATOM     13  C   LIG    1        6.173   0.778  -0.535  0.00  0.00    +0.004 A 
ENDBRANCH   1   9
BRANCH   1  14
ATOM     14  C   LIG    1       -1.074  -0.132   1.184  0.00  0.00    +0.074 C 
ATOM     15  C   LIG    1       -1.573  -0.563  -0.213  0.00  0.00    +0.095 C 
ATOM     16  N   LIG    1       -2.779   0.103  -0.731  0.00  0.00    -0.301 NA
ATOM     17  C   LIG    1       -2.833   1.493  -0.270  0.00  0.00    +0.084 C 
ATOM     18  C   LIG    1       -2.933   1.635   1.249  0.00  0.00    +0.016 C 
ATOM     19  C   LIG    1       -2.162   0.560   2.016  0.00  0.00    +0.014 C 
BRANCH  16  20
ATOM     20  C   LIG    1       -4.001  -0.666  -0.482  0.00  0.00    +0.088 C 
BRANCH  20  21
ATOM     21  C   LIG    1       -5.136  -0.144  -1.314  0.00  0.00    +0.003 C 
ATOM     22  C   LIG    1       -6.197   0.753  -0.724  0.00  0.00    +0.005 C 
ATOM     23  C   LIG    1       -6.534  -0.666  -1.083  0.00  0.00    +0.005 C 
ENDBRANCH  20  21
ENDBRANCH  16  20
ENDBRANCH   1  14
TORSDOF 4