REMARK  Name = BDB013836
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        2.756  -1.457   0.824  0.00  0.00    -0.338 N 
ATOM      2  H   LIG    1        2.733  -1.975  -0.064  0.00  0.00    +0.146 HD
ENDROOT
BRANCH   1   3
ATOM      3  C   LIG    1        3.065  -0.107   0.588  0.00  0.00    +0.060 A 
ATOM      4  C   LIG    1        3.773   0.294  -0.560  0.00  0.00    +0.082 A 
ATOM      5  C   LIG    1        4.107   1.636  -0.781  0.00  0.00    +0.036 A 
ATOM      6  C   LIG    1        3.782   2.553   0.197  0.00  0.00    +0.111 A 
ATOM      7  N   LIG    1        3.176   2.217   1.349  0.00  0.00    -0.261 NA
ATOM      8  C   LIG    1        2.841   0.910   1.516  0.00  0.00    +0.134 A 
BRANCH   4   9
ATOM      9  C   LIG    1        4.128  -0.705  -1.594  0.00  0.00    +0.339 C 
ATOM     10  O   LIG    1        3.366  -1.582  -1.966  0.00  0.00    -0.245 OA
BRANCH   9  11
ATOM     11  O   LIG    1        5.393  -0.572  -2.047  0.00  0.00    -0.477 OA
ATOM     12  H   LIG    1        5.953   0.021  -1.510  0.00  0.00    +0.295 HD
ENDBRANCH   9  11
ENDBRANCH   4   9
ENDBRANCH   1   3
BRANCH   1  13
ATOM     13  C   LIG    1        1.603  -1.816   1.649  0.00  0.00    +0.137 C 
BRANCH  13  17
ATOM     14  C   LIG    1       -2.162  -0.650  -0.158  0.00  0.00    +0.121 A 
ATOM     15  C   LIG    1       -1.788  -0.142   1.084  0.00  0.00    +0.046 A 
ATOM     16  C   LIG    1       -0.572  -0.521   1.666  0.00  0.00    +0.009 A 
ATOM     17  C   LIG    1        0.293  -1.410   1.013  0.00  0.00    -0.030 A 
ATOM     18  C   LIG    1       -0.090  -1.917  -0.235  0.00  0.00    +0.009 A 
ATOM     19  C   LIG    1       -1.304  -1.536  -0.812  0.00  0.00    +0.046 A 
BRANCH  14  20
ATOM     20  O   LIG    1       -3.309  -0.366  -0.843  0.00  0.00    -0.489 OA
BRANCH  20  22
ATOM     21  C   LIG    1       -4.048   1.915  -0.498  0.00  0.00    +0.051 C 
ATOM     22  C   LIG    1       -4.316   0.439  -0.222  0.00  0.00    +0.167 C 
ATOM     23  C   LIG    1       -5.650   0.027  -0.843  0.00  0.00    +0.051 C 
ENDBRANCH  20  22
ENDBRANCH  14  20
ENDBRANCH  13  17
ENDBRANCH   1  13
TORSDOF 7