REMARK  Name = BDB018764
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.698   0.087   0.552  0.00  0.00    -0.016 A 
ATOM      2  C   LIG    1       -0.659  -0.128  -0.364  0.00  0.00    +0.014 A 
ATOM      3  C   LIG    1        0.605  -0.531   0.083  0.00  0.00    -0.025 A 
ATOM      4  C   LIG    1        1.710  -0.853  -0.887  0.00  0.00    +0.054 C 
ATOM      5  C   LIG    1        3.091  -0.583  -0.277  0.00  0.00    +0.069 C 
ATOM      6  C   LIG    1        3.364   0.923  -0.104  0.00  0.00    +0.132 C 
ATOM      7  N   LIG    1        4.779   1.148  -0.532  0.00  0.00    -0.268 N 
ATOM      8  C   LIG    1        5.393  -0.166  -0.838  0.00  0.00    +0.117 C 
ATOM      9  C   LIG    1        3.176  -1.266   1.089  0.00  0.00    +0.225 C 
ATOM     10  N   LIG    1        2.073  -1.154   1.896  0.00  0.00    -0.285 N 
ATOM     11  H   LIG    1        2.186  -1.484   2.847  0.00  0.00    +0.155 HD
ATOM     12  O   LIG    1        4.190  -1.822   1.506  0.00  0.00    -0.275 OA
ATOM     13  C   LIG    1        4.210  -1.043  -1.216  0.00  0.00    +0.037 C 
ATOM     14  C   LIG    1        0.819  -0.726   1.451  0.00  0.00    +0.037 A 
ATOM     15  C   LIG    1       -0.210  -0.529   2.369  0.00  0.00    +0.024 A 
ATOM     16  C   LIG    1       -1.466  -0.114   1.920  0.00  0.00    +0.010 A 
ENDROOT
BRANCH   1  23
ATOM     17  C   LIG    1       -6.305  -1.079  -0.460  0.00  0.00    +0.152 C 
ATOM     18  N   LIG    1       -5.285  -0.043  -0.424  0.00  0.00    -0.318 N 
ATOM     19  C   LIG    1       -5.611   1.247  -0.839  0.00  0.00    +0.251 A 
ATOM     20  O   LIG    1       -6.715   1.603  -1.243  0.00  0.00    -0.268 OA
ATOM     21  C   LIG    1       -4.510   2.244  -0.773  0.00  0.00    +0.071 A 
ATOM     22  C   LIG    1       -3.295   1.885  -0.340  0.00  0.00    +0.015 A 
ATOM     23  C   LIG    1       -3.021   0.524   0.077  0.00  0.00    -0.001 A 
ATOM     24  C   LIG    1       -4.015  -0.380   0.019  0.00  0.00    +0.097 A 
ENDBRANCH   1  23
BRANCH   7  25
ATOM     25  C   LIG    1        5.484   2.243  -0.216  0.00  0.00    +0.169 C 
ATOM     26  N   LIG    1        6.085   3.192   0.061  0.00  0.00    -0.174 NA
ENDBRANCH   7  25
TORSDOF 2