REMARK  Name = BDB000550
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.524  -1.636   1.119  0.00  0.00    +0.233 C 
ATOM      2  O   LIG    1        0.226  -2.820   1.011  0.00  0.00    -0.283 OA
ENDROOT
BRANCH   1   6
ATOM      3  C   LIG    1        4.335  -0.203  -0.262  0.00  0.00    +0.120 A 
ATOM      4  C   LIG    1        3.979  -1.548  -0.387  0.00  0.00    +0.046 A 
ATOM      5  C   LIG    1        2.740  -2.003   0.071  0.00  0.00    +0.015 A 
ATOM      6  C   LIG    1        1.838  -1.112   0.662  0.00  0.00    +0.026 A 
ATOM      7  C   LIG    1        2.192   0.236   0.788  0.00  0.00    +0.015 A 
ATOM      8  C   LIG    1        3.437   0.687   0.328  0.00  0.00    +0.046 A 
BRANCH   3  10
ATOM      9  C   LIG    1        5.998   1.459  -0.618  0.00  0.00    +0.277 C 
ATOM     10  O   LIG    1        5.573   0.108  -0.751  0.00  0.00    -0.495 OA
ENDBRANCH   3  10
ENDBRANCH   1   6
BRANCH   1  11
ATOM     11  C   LIG    1       -0.500  -0.690   1.701  0.00  0.00    +0.233 C 
ATOM     12  O   LIG    1       -0.245  -0.136   2.764  0.00  0.00    -0.283 OA
BRANCH  11  13
ATOM     13  C   LIG    1       -1.762  -0.423   0.963  0.00  0.00    +0.026 A 
ATOM     14  C   LIG    1       -2.682   0.477   1.518  0.00  0.00    +0.015 A 
ATOM     15  C   LIG    1       -3.877   0.776   0.853  0.00  0.00    +0.046 A 
ATOM     16  C   LIG    1       -4.164   0.177  -0.373  0.00  0.00    +0.120 A 
ATOM     17  C   LIG    1       -3.247  -0.722  -0.925  0.00  0.00    +0.046 A 
ATOM     18  C   LIG    1       -2.051  -1.024  -0.266  0.00  0.00    +0.015 A 
BRANCH  16  19
ATOM     19  O   LIG    1       -5.288   0.379  -1.124  0.00  0.00    -0.495 OA
ATOM     20  C   LIG    1       -6.271   1.256  -0.590  0.00  0.00    +0.277 C 
ENDBRANCH  16  19
ENDBRANCH  11  13
ENDBRANCH   1  11
TORSDOF 5