REMARK  Name = BDB018721
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        3.705  -0.184   0.547  0.00  0.00    +0.038 C 
ATOM      2  C   LIG    1        2.191  -0.314   0.480  0.00  0.00    +0.156 C 
ATOM      3  C   LIG    1        1.519   1.078   0.481  0.00  0.00    +0.234 C 
ATOM      4  O   LIG    1        1.949   2.055   1.084  0.00  0.00    -0.274 OA
ATOM      5  N   LIG    1        0.298   1.131  -0.154  0.00  0.00    -0.299 N 
ATOM      6  H   LIG    1       -0.204   2.005  -0.034  0.00  0.00    +0.150 HD
ATOM      7  C   LIG    1       -0.465  -0.095  -0.438  0.00  0.00    +0.128 C 
ATOM      8  C   LIG    1       -1.672   0.184  -1.346  0.00  0.00    +0.151 C 
ATOM      9  N   LIG    1       -2.720   0.711  -0.416  0.00  0.00    -0.267 N 
ATOM     10  C   LIG    1       -2.391   0.254   0.961  0.00  0.00    +0.119 C 
ATOM     11  C   LIG    1       -1.153  -0.627   0.820  0.00  0.00    +0.056 C 
ATOM     12  C   LIG    1        0.460  -1.154  -1.069  0.00  0.00    +0.239 C 
ATOM     13  O   LIG    1        0.070  -2.082  -1.770  0.00  0.00    -0.273 OA
ATOM     14  N   LIG    1        1.785  -1.075  -0.698  0.00  0.00    -0.302 N 
ATOM     15  H   LIG    1        2.337  -1.874  -0.989  0.00  0.00    +0.150 HD
ENDROOT
BRANCH   9  16
ATOM     16  C   LIG    1       -3.941   1.097  -0.808  0.00  0.00    +0.169 C 
ATOM     17  N   LIG    1       -4.997   1.427  -1.144  0.00  0.00    -0.174 NA
ENDBRANCH   9  16
TORSDOF 1