REMARK  Name = BDB002024
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.642  -0.582   1.603  0.00  0.00    +0.212 C 
ENDROOT
BRANCH   1   2
ATOM      2  N   LIG    1        2.656  -0.238   0.632  0.00  0.00    -0.233 N 
ATOM      3  C   LIG    1        3.414  -1.168  -0.020  0.00  0.00    +0.227 C 
ATOM      4  O   LIG    1        3.425  -2.372   0.190  0.00  0.00    -0.275 OA
ATOM      5  C   LIG    1        4.292  -0.467  -1.018  0.00  0.00    +0.095 C 
ATOM      6  C   LIG    1        3.961   1.037  -0.825  0.00  0.00    +0.095 C 
ATOM      7  C   LIG    1        5.314   1.635  -0.391  0.00  0.00    +0.025 C 
ATOM      8  C   LIG    1        5.920   0.504   0.452  0.00  0.00    +0.016 C 
ATOM      9  C   LIG    1        6.244   1.530  -1.583  0.00  0.00    -0.027 C 
ATOM     10  C   LIG    1        6.530   0.228  -1.750  0.00  0.00    -0.027 C 
ATOM     11  C   LIG    1        5.793  -0.536  -0.669  0.00  0.00    +0.025 C 
ATOM     12  C   LIG    1        2.924   1.049   0.263  0.00  0.00    +0.227 C 
ATOM     13  O   LIG    1        2.442   2.059   0.754  0.00  0.00    -0.275 OA
ENDBRANCH   1   2
BRANCH   1  15
ATOM     14  O   LIG    1        0.162  -0.686  -0.328  0.00  0.00    -0.274 OA
ATOM     15  C   LIG    1        0.297  -0.749   0.891  0.00  0.00    +0.231 C 
ATOM     16  N   LIG    1       -0.757  -0.989   1.752  0.00  0.00    -0.314 N 
ATOM     17  H   LIG    1       -0.616  -0.910   2.751  0.00  0.00    +0.149 HD
BRANCH  16  18
ATOM     18  C   LIG    1       -2.118  -1.125   1.264  0.00  0.00    +0.108 C 
BRANCH  18  19
ATOM     19  C   LIG    1       -2.768   0.235   0.985  0.00  0.00    +0.049 C 
BRANCH  19  20
ATOM     20  C   LIG    1       -4.215   0.115   0.565  0.00  0.00    -0.072 C 
ATOM     21  C   LIG    1       -4.471  -0.326  -0.859  0.00  0.00    +0.030 C 
ATOM     22  C   LIG    1       -5.928  -0.714  -1.125  0.00  0.00    +0.005 C 
ATOM     23  C   LIG    1       -6.891   0.284  -0.494  0.00  0.00    +0.004 C 
ATOM     24  C   LIG    1       -6.673   0.378   1.016  0.00  0.00    +0.027 C 
ATOM     25  C   LIG    1       -5.223   0.421   1.403  0.00  0.00    -0.028 C 
ENDBRANCH  19  20
ENDBRANCH  18  19
ENDBRANCH  16  18
ENDBRANCH   1  15
TORSDOF 5