REMARK  Name = BDB065250
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        5.651   0.068   0.082  0.00  0.00    +0.122 A 
ATOM      2  C   LIG    1        4.924  -1.058  -0.319  0.00  0.00    +0.074 A 
ATOM      3  C   LIG    1        3.536  -1.069  -0.364  0.00  0.00    +0.081 A 
ATOM      4  C   LIG    1        2.839   0.093  -0.006  0.00  0.00    +0.040 A 
ATOM      5  C   LIG    1        1.431   0.021  -0.086  0.00  0.00    +0.131 A 
ATOM      6  N   LIG    1        0.808  -1.108  -0.444  0.00  0.00    -0.203 NA
ATOM      7  C   LIG    1        1.578  -2.160  -0.755  0.00  0.00    +0.234 A 
ATOM      8  C   LIG    1        3.572   1.232   0.411  0.00  0.00    +0.017 A 
ATOM      9  N   LIG    1        2.919  -2.190  -0.743  0.00  0.00    -0.218 NA
ATOM     10  C   LIG    1        4.968   1.218   0.452  0.00  0.00    +0.046 A 
ENDROOT
BRANCH   1  12
ATOM     11  C   LIG    1        7.796   1.017   0.483  0.00  0.00    +0.277 C 
ATOM     12  O   LIG    1        7.008  -0.093   0.069  0.00  0.00    -0.495 OA
ENDBRANCH   1  12
BRANCH   7  13
ATOM     13  C   LIG    1        0.902  -3.368  -1.151  0.00  0.00    +0.140 C 
ATOM     14  N   LIG    1        0.362  -4.347  -1.475  0.00  0.00    -0.188 NA
ENDBRANCH   7  13
BRANCH   5  15
ATOM     15  N   LIG    1        0.671   1.153   0.244  0.00  0.00    -0.326 N 
ATOM     16  H   LIG    1        1.013   1.942  -0.298  0.00  0.00    +0.148 HD
BRANCH  15  17
ATOM     17  C   LIG    1       -0.801   1.132   0.262  0.00  0.00    +0.074 C 
ATOM     18  C   LIG    1       -1.433   0.922  -1.107  0.00  0.00    +0.037 C 
ATOM     19  C   LIG    1       -2.958   1.023  -1.007  0.00  0.00    +0.086 C 
ATOM     20  N   LIG    1       -3.530   0.092  -0.014  0.00  0.00    -0.300 NA
ATOM     21  C   LIG    1       -2.917   0.304   1.313  0.00  0.00    +0.086 C 
ATOM     22  C   LIG    1       -1.392   0.178   1.291  0.00  0.00    +0.037 C 
BRANCH  20  23
ATOM     23  C   LIG    1       -5.016   0.177   0.039  0.00  0.00    +0.050 C 
ATOM     24  C   LIG    1       -5.668  -0.087  -1.330  0.00  0.00    +0.024 C 
ATOM     25  C   LIG    1       -5.625  -0.828   1.033  0.00  0.00    +0.024 C 
ENDBRANCH  20  23
ENDBRANCH  15  17
ENDBRANCH   5  15
TORSDOF 5