REMARK  Name = BDB002169
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.655   0.227  -2.445  0.00  0.00    +0.083 C 
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1       -2.764   0.326  -1.423  0.00  0.00    +0.111 A 
ATOM      3  N   LIG    1       -2.685   1.370  -0.543  0.00  0.00    -0.310 N 
ATOM      4  H   LIG    1       -1.879   1.994  -0.565  0.00  0.00    +0.170 HD
ATOM      5  C   LIG    1       -3.591   1.578   0.465  0.00  0.00    +0.259 A 
ATOM      6  O   LIG    1       -3.482   2.488   1.278  0.00  0.00    -0.267 OA
ATOM      7  C   LIG    1       -4.708   0.619   0.515  0.00  0.00    +0.065 A 
ATOM      8  C   LIG    1       -4.715  -0.412  -0.428  0.00  0.00    +0.078 A 
ATOM      9  C   LIG    1       -5.762  -1.336  -0.398  0.00  0.00    +0.028 A 
ATOM     10  C   LIG    1       -6.778  -1.229   0.556  0.00  0.00    +0.002 A 
ATOM     11  C   LIG    1       -6.757  -0.195   1.492  0.00  0.00    +0.001 A 
ATOM     12  C   LIG    1       -5.718   0.736   1.476  0.00  0.00    +0.015 A 
ATOM     13  N   LIG    1       -3.711  -0.555  -1.401  0.00  0.00    -0.234 NA
ENDBRANCH   1   2
BRANCH   1  14
ATOM     14  C   LIG    1       -0.381  -0.341  -1.822  0.00  0.00    +0.103 C 
BRANCH  14  19
ATOM     15  N   LIG    1        4.125  -0.395   0.800  0.00  0.00    -0.300 NA
ATOM     16  C   LIG    1        3.541  -1.278  -0.222  0.00  0.00    +0.103 C 
ATOM     17  C   LIG    1        2.015  -1.089  -0.339  0.00  0.00    +0.123 C 
ATOM     18  N   LIG    1        1.629   0.316  -0.520  0.00  0.00    -0.299 N 
ATOM     19  C   LIG    1        0.408   0.709  -1.054  0.00  0.00    +0.216 C 
ATOM     20  O   LIG    1       -0.032   1.854  -0.922  0.00  0.00    -0.276 OA
ATOM     21  C   LIG    1        2.303   1.257   0.382  0.00  0.00    +0.123 C 
ATOM     22  C   LIG    1        3.819   1.010   0.479  0.00  0.00    +0.103 C 
BRANCH  15  24
ATOM     23  C   LIG    1        6.497  -0.394  -0.142  0.00  0.00    +0.020 C 
ATOM     24  C   LIG    1        5.552  -0.638   1.032  0.00  0.00    +0.081 C 
ENDBRANCH  15  24
ENDBRANCH  14  19
ENDBRANCH   1  14
TORSDOF 4