REMARK  Name = BDB027615
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.025  -0.956   0.230  0.00  0.00    +0.131 A 
ATOM      2  C   LIG    1        0.562  -2.212  -0.093  0.00  0.00    +0.043 A 
ATOM      3  C   LIG    1        1.933  -2.230  -0.354  0.00  0.00    +0.095 A 
ATOM      4  C   LIG    1        2.474  -3.463  -0.687  0.00  0.00    +0.139 A 
ATOM      5  N   LIG    1        1.797  -4.638  -0.773  0.00  0.00    -0.261 NA
ATOM      6  C   LIG    1        0.482  -4.589  -0.497  0.00  0.00    +0.111 A 
ATOM      7  N   LIG    1        2.704  -1.135  -0.290  0.00  0.00    -0.226 NA
ATOM      8  C   LIG    1        2.107   0.015   0.060  0.00  0.00    +0.162 A 
ATOM      9  C   LIG    1       -0.173  -3.420  -0.158  0.00  0.00    +0.033 A 
ATOM     10  N   LIG    1        0.797   0.139   0.325  0.00  0.00    -0.212 NA
ENDROOT
BRANCH   8  11
ATOM     11  C   LIG    1        2.942   1.227   0.148  0.00  0.00    +0.022 A 
ATOM     12  C   LIG    1        4.317   1.194  -0.128  0.00  0.00    +0.031 A 
ATOM     13  C   LIG    1        5.060   2.361  -0.033  0.00  0.00    +0.111 A 
ATOM     14  N   LIG    1        4.540   3.555   0.315  0.00  0.00    -0.263 NA
ATOM     15  C   LIG    1        3.220   3.582   0.580  0.00  0.00    +0.111 A 
ATOM     16  C   LIG    1        2.397   2.468   0.511  0.00  0.00    +0.031 A 
ENDBRANCH   8  11
BRANCH   1  17
ATOM     17  N   LIG    1       -1.353  -0.842   0.494  0.00  0.00    -0.325 N 
ATOM     18  H   LIG    1       -1.884  -1.269  -0.259  0.00  0.00    +0.148 HD
BRANCH  17  21
ATOM     19  C   LIG    1       -1.595   1.395  -1.552  0.00  0.00    +0.009 C 
ATOM     20  C   LIG    1       -2.457   1.276  -0.305  0.00  0.00    +0.006 C 
ATOM     21  C   LIG    1       -1.871   0.476   0.872  0.00  0.00    +0.075 C 
ATOM     22  C   LIG    1       -3.119   0.268   1.742  0.00  0.00    +0.022 C 
ATOM     23  C   LIG    1       -4.269   0.041   0.761  0.00  0.00    +0.002 C 
ATOM     24  C   LIG    1       -3.811   0.614  -0.580  0.00  0.00    +0.005 C 
ENDBRANCH  17  21
ENDBRANCH   1  17
TORSDOF 3