REMARK  Name = BDB018284
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.839  -3.514  -3.883  0.00  0.00    +0.152 C 
ATOM      2  N   LIG    1        1.934  -2.551  -2.798  0.00  0.00    -0.318 N 
ATOM      3  C   LIG    1        3.161  -1.980  -2.510  0.00  0.00    +0.253 A 
ATOM      4  O   LIG    1        4.206  -2.202  -3.113  0.00  0.00    -0.268 OA
ATOM      5  C   LIG    1        3.167  -1.010  -1.389  0.00  0.00    +0.097 A 
ATOM      6  C   LIG    1        2.069  -0.721  -0.655  0.00  0.00    +0.060 A 
ATOM      7  C   LIG    1        0.835  -1.502  -0.939  0.00  0.00    +0.025 A 
ATOM      8  C   LIG    1        0.829  -2.338  -1.999  0.00  0.00    +0.099 A 
ENDROOT
BRANCH   6   9
ATOM      9  N   LIG    1        2.126   0.326   0.312  0.00  0.00    -0.321 N 
ATOM     10  C   LIG    1        3.273   0.799   0.952  0.00  0.00    +0.104 A 
ATOM     11  C   LIG    1        2.961   1.830   1.824  0.00  0.00    +0.054 A 
ATOM     12  C   LIG    1        1.564   2.026   1.695  0.00  0.00    +0.032 A 
ATOM     13  C   LIG    1        1.091   1.123   0.772  0.00  0.00    +0.092 A 
BRANCH  11  14
ATOM     14  C   LIG    1        3.856   2.583   2.693  0.00  0.00    +0.243 C 
ATOM     15  O   LIG    1        3.487   3.530   3.379  0.00  0.00    -0.270 OA
ATOM     16  N   LIG    1        5.157   2.173   2.726  0.00  0.00    -0.325 N 
ATOM     17  H   LIG    1        5.764   2.639   3.386  0.00  0.00    +0.145 HD
ATOM     18  H   LIG    1        5.474   1.323   2.290  0.00  0.00    +0.145 HD
ENDBRANCH  11  14
ENDBRANCH   6   9
BRANCH   7  19
ATOM     19  C   LIG    1       -0.305  -1.508  -0.070  0.00  0.00    +0.023 A 
ATOM     20  C   LIG    1       -1.601  -1.200  -0.416  0.00  0.00    +0.117 A 
ATOM     21  N   LIG    1       -2.333  -1.311   0.736  0.00  0.00    -0.267 N 
ATOM     22  N   LIG    1       -1.607  -1.752   1.787  0.00  0.00    -0.179 NA
ATOM     23  C   LIG    1       -0.368  -1.853   1.296  0.00  0.00    +0.143 A 
BRANCH  21  24
ATOM     24  C   LIG    1       -3.752  -1.021   0.899  0.00  0.00    +0.178 C 
BRANCH  24  25
ATOM     25  C   LIG    1       -4.030   0.460   0.815  0.00  0.00    -0.026 A 
ATOM     26  C   LIG    1       -4.836   0.979  -0.210  0.00  0.00    +0.005 A 
ATOM     27  C   LIG    1       -5.088   2.350  -0.286  0.00  0.00    +0.000 A 
ATOM     28  C   LIG    1       -4.542   3.215   0.660  0.00  0.00    +0.000 A 
ATOM     29  C   LIG    1       -3.744   2.712   1.686  0.00  0.00    +0.000 A 
ATOM     30  C   LIG    1       -3.491   1.342   1.765  0.00  0.00    +0.005 A 
ENDBRANCH  24  25
ENDBRANCH  21  24
ENDBRANCH   7  19
TORSDOF 5