REMARK  Name = BDB018268
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.376  -0.636   0.054  0.00  0.00    +0.135 A 
ATOM      2  C   LIG    1        0.732   0.325  -0.067  0.00  0.00    +0.043 A 
ATOM      3  C   LIG    1        1.986  -0.171  -0.102  0.00  0.00    +0.101 A 
ATOM      4  N   LIG    1        2.263  -1.524  -0.017  0.00  0.00    -0.317 N 
ATOM      5  C   LIG    1        3.654  -1.951  -0.047  0.00  0.00    +0.152 C 
ATOM      6  C   LIG    1        1.263  -2.474   0.124  0.00  0.00    +0.255 A 
ATOM      7  O   LIG    1        1.445  -3.684   0.224  0.00  0.00    -0.268 OA
ATOM      8  C   LIG    1       -0.126  -1.953   0.147  0.00  0.00    +0.116 A 
ENDROOT
BRANCH   2   9
ATOM      9  C   LIG    1        0.518   1.742  -0.147  0.00  0.00    +0.024 A 
ATOM     10  C   LIG    1       -0.281   2.508   0.671  0.00  0.00    +0.113 A 
ATOM     11  N   LIG    1       -0.161   3.792   0.225  0.00  0.00    -0.284 N 
ATOM     12  H   LIG    1       -0.616   4.625   0.583  0.00  0.00    +0.188 HD
ATOM     13  N   LIG    1        0.681   3.922  -0.815  0.00  0.00    -0.182 NA
ATOM     14  C   LIG    1        1.087   2.671  -1.047  0.00  0.00    +0.142 A 
ENDBRANCH   2   9
BRANCH   1  15
ATOM     15  O   LIG    1       -1.632  -0.063   0.037  0.00  0.00    -0.491 OA
BRANCH  15  17
ATOM     16  C   LIG    1       -4.013  -0.045   0.066  0.00  0.00    +0.048 C 
ATOM     17  C   LIG    1       -2.772  -0.917   0.110  0.00  0.00    +0.226 C 
ENDBRANCH  15  17
ENDBRANCH   1  15
TORSDOF 3