REMARK  Name = BDB028025
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1       -0.438  -0.364  -0.704  0.00  0.00    -0.479 OA
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1        0.948  -0.511  -0.373  0.00  0.00    +0.259 C 
ATOM      3  C   LIG    1        1.521  -1.801  -0.974  0.00  0.00    +0.260 C 
ATOM      4  O   LIG    1        0.856  -2.814  -1.182  0.00  0.00    -0.271 OA
ATOM      5  N   LIG    1        2.871  -1.796  -1.246  0.00  0.00    -0.253 N 
ATOM      6  H   LIG    1        3.242  -2.649  -1.642  0.00  0.00    +0.158 HD
ATOM      7  C   LIG    1        3.728  -0.725  -1.232  0.00  0.00    +0.219 C 
ATOM      8  O   LIG    1        4.890  -0.839  -1.608  0.00  0.00    -0.275 OA
ATOM      9  C   LIG    1        3.178   0.568  -0.682  0.00  0.00    +0.100 C 
ATOM     10  C   LIG    1        1.690   0.690  -0.955  0.00  0.00    +0.063 C 
ENDBRANCH   1   2
BRANCH   1  12
ATOM     11  C   LIG    1       -1.899   0.734   0.856  0.00  0.00    +0.059 A 
ATOM     12  C   LIG    1       -1.244  -0.415   0.403  0.00  0.00    +0.132 A 
ATOM     13  C   LIG    1       -1.431  -1.631   1.066  0.00  0.00    +0.046 A 
ATOM     14  C   LIG    1       -2.221  -1.685   2.216  0.00  0.00    +0.004 A 
ATOM     15  C   LIG    1       -2.830  -0.529   2.702  0.00  0.00    +0.001 A 
ATOM     16  C   LIG    1       -2.670   0.681   2.024  0.00  0.00    +0.015 A 
BRANCH  11  18
ATOM     17  C   LIG    1       -1.938   2.070  -1.339  0.00  0.00    +0.092 C 
ATOM     18  C   LIG    1       -1.791   2.036   0.160  0.00  0.00    +0.164 C 
ATOM     19  O   LIG    1       -1.603   3.056   0.819  0.00  0.00    -0.292 OA
ENDBRANCH  11  18
ENDBRANCH   1  12
TORSDOF 3