REMARK  Name = BDB018399
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.667   1.304  -0.432  0.00  0.00    +0.023 A 
ATOM      2  C   LIG    1        0.481   1.041   0.283  0.00  0.00    +0.117 A 
ATOM      3  N   LIG    1        1.519   1.493  -0.487  0.00  0.00    -0.267 N 
ATOM      4  N   LIG    1        1.115   2.064  -1.642  0.00  0.00    -0.179 NA
ATOM      5  C   LIG    1       -0.214   1.926  -1.615  0.00  0.00    +0.143 A 
ENDROOT
BRANCH   1  12
ATOM      6  C   LIG    1       -3.808  -1.988   1.238  0.00  0.00    +0.152 C 
ATOM      7  N   LIG    1       -3.590  -0.626   0.778  0.00  0.00    -0.318 N 
ATOM      8  C   LIG    1       -4.672   0.234   0.663  0.00  0.00    +0.253 A 
ATOM      9  O   LIG    1       -5.834  -0.050   0.940  0.00  0.00    -0.268 OA
ATOM     10  C   LIG    1       -4.359   1.599   0.176  0.00  0.00    +0.093 A 
ATOM     11  C   LIG    1       -3.108   1.972  -0.147  0.00  0.00    +0.039 A 
ATOM     12  C   LIG    1       -2.011   0.988  -0.040  0.00  0.00    +0.022 A 
ATOM     13  C   LIG    1       -2.309  -0.245   0.420  0.00  0.00    +0.099 A 
BRANCH  11  14
ATOM     14  N   LIG    1       -2.831   3.269  -0.557  0.00  0.00    -0.357 N 
ATOM     15  H   LIG    1       -3.554   3.940  -0.306  0.00  0.00    +0.142 HD
ATOM     16  H   LIG    1       -1.911   3.589  -0.257  0.00  0.00    +0.142 HD
ENDBRANCH  11  14
ENDBRANCH   1  12
BRANCH   3  17
ATOM     17  C   LIG    1        2.937   1.450  -0.150  0.00  0.00    +0.178 C 
BRANCH  17  18
ATOM     18  C   LIG    1        3.478   0.042  -0.177  0.00  0.00    -0.026 A 
ATOM     19  C   LIG    1        3.922  -0.576   1.001  0.00  0.00    +0.005 A 
ATOM     20  C   LIG    1        4.424  -1.879   0.971  0.00  0.00    +0.000 A 
ATOM     21  C   LIG    1        4.489  -2.575  -0.235  0.00  0.00    +0.000 A 
ATOM     22  C   LIG    1        4.053  -1.970  -1.412  0.00  0.00    +0.000 A 
ATOM     23  C   LIG    1        3.552  -0.668  -1.385  0.00  0.00    +0.005 A 
ENDBRANCH  17  18
ENDBRANCH   3  17
TORSDOF 4