REMARK  Name = BDB027803
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.290   0.145  -0.839  0.00  0.00    +0.039 A 
ATOM      2  C   LIG    1        0.862   1.175  -1.640  0.00  0.00    +0.024 A 
ATOM      3  C   LIG    1        2.256   1.356  -1.593  0.00  0.00    +0.091 A 
ATOM      4  C   LIG    1        2.781   2.358  -2.397  0.00  0.00    +0.139 A 
ATOM      5  N   LIG    1        2.076   3.183  -3.215  0.00  0.00    -0.261 NA
ATOM      6  C   LIG    1        0.746   3.004  -3.224  0.00  0.00    +0.111 A 
ATOM      7  N   LIG    1        3.068   0.619  -0.816  0.00  0.00    -0.245 NA
ATOM      8  C   LIG    1        2.523  -0.327  -0.021  0.00  0.00    +0.074 A 
ATOM      9  C   LIG    1        0.105   2.035  -2.470  0.00  0.00    +0.031 A 
ATOM     10  C   LIG    1        1.152  -0.582  -0.020  0.00  0.00    +0.052 A 
ENDROOT
BRANCH   8  11
ATOM     11  C   LIG    1        3.478  -1.075   0.821  0.00  0.00    +0.003 A 
ATOM     12  C   LIG    1        4.784  -1.325   0.375  0.00  0.00    +0.030 A 
ATOM     13  C   LIG    1        5.659  -2.032   1.184  0.00  0.00    +0.111 A 
ATOM     14  N   LIG    1        5.334  -2.507   2.403  0.00  0.00    -0.263 NA
ATOM     15  C   LIG    1        4.083  -2.251   2.834  0.00  0.00    +0.111 A 
ATOM     16  C   LIG    1        3.138  -1.553   2.095  0.00  0.00    +0.030 A 
ENDBRANCH   8  11
BRANCH   1  17
ATOM     17  N   LIG    1       -1.090  -0.057  -0.884  0.00  0.00    -0.338 N 
ATOM     18  H   LIG    1       -1.394  -0.096  -1.857  0.00  0.00    +0.147 HD
BRANCH  17  19
ATOM     19  C   LIG    1       -1.963  -0.878  -0.017  0.00  0.00    +0.029 C 
ATOM     20  C   LIG    1       -1.740  -0.600   1.476  0.00  0.00    +0.031 C 
ATOM     21  C   LIG    1       -1.763  -2.372  -0.335  0.00  0.00    +0.031 C 
BRANCH  19  22
ATOM     22  C   LIG    1       -3.435  -0.524  -0.410  0.00  0.00    +0.053 C 
BRANCH  22  23
ATOM     23  C   LIG    1       -3.872   0.905  -0.083  0.00  0.00    +0.161 C 
BRANCH  23  25
ATOM     24  C   LIG    1       -4.618   2.310   1.657  0.00  0.00    +0.193 C 
ATOM     25  O   LIG    1       -4.254   0.986   1.290  0.00  0.00    -0.383 OA
ENDBRANCH  23  25
ENDBRANCH  22  23
ENDBRANCH  19  22
ENDBRANCH  17  19
ENDBRANCH   1  17
TORSDOF 6