REMARK  Name = BDB027598
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.069  -1.170  -0.382  0.00  0.00    +0.131 A 
ATOM      2  C   LIG    1        0.687  -2.216  -0.945  0.00  0.00    +0.043 A 
ATOM      3  C   LIG    1        2.064  -2.000  -1.010  0.00  0.00    +0.095 A 
ATOM      4  C   LIG    1        2.817  -3.015  -1.581  0.00  0.00    +0.139 A 
ATOM      5  N   LIG    1        2.340  -4.191  -2.067  0.00  0.00    -0.261 NA
ATOM      6  C   LIG    1        1.013  -4.378  -1.972  0.00  0.00    +0.111 A 
ATOM      7  N   LIG    1        2.650  -0.887  -0.553  0.00  0.00    -0.226 NA
ATOM      8  C   LIG    1        1.854   0.033   0.014  0.00  0.00    +0.162 A 
ATOM      9  C   LIG    1        0.157  -3.437  -1.429  0.00  0.00    +0.033 A 
ATOM     10  N   LIG    1        0.518  -0.071   0.117  0.00  0.00    -0.212 NA
ENDROOT
BRANCH   8  11
ATOM     11  C   LIG    1        2.501   1.240   0.559  0.00  0.00    +0.022 A 
ATOM     12  C   LIG    1        3.804   1.604   0.187  0.00  0.00    +0.031 A 
ATOM     13  C   LIG    1        4.373   2.748   0.724  0.00  0.00    +0.111 A 
ATOM     14  N   LIG    1        3.746   3.554   1.603  0.00  0.00    -0.263 NA
ATOM     15  C   LIG    1        2.498   3.197   1.963  0.00  0.00    +0.111 A 
ATOM     16  C   LIG    1        1.849   2.072   1.479  0.00  0.00    +0.031 A 
ENDBRANCH   8  11
BRANCH   1  17
ATOM     17  N   LIG    1       -1.467  -1.309  -0.328  0.00  0.00    -0.323 N 
ATOM     18  H   LIG    1       -1.790  -1.562  -1.258  0.00  0.00    +0.148 HD
BRANCH  17  20
ATOM     19  C   LIG    1       -3.785  -0.863   0.122  0.00  0.00    +0.031 C 
ATOM     20  C   LIG    1       -2.353  -0.281   0.252  0.00  0.00    +0.031 C 
ATOM     21  C   LIG    1       -2.081  -0.102   1.753  0.00  0.00    +0.031 C 
BRANCH  20  22
ATOM     22  C   LIG    1       -2.295   0.991  -0.584  0.00  0.00    +0.012 C 
ATOM     23  C   LIG    1       -1.668   2.287  -0.119  0.00  0.00    +0.006 C 
ATOM     24  C   LIG    1       -3.157   2.194  -0.262  0.00  0.00    +0.006 C 
ENDBRANCH  20  22
ENDBRANCH  17  20
ENDBRANCH   1  17
TORSDOF 4