REMARK  Name = BDB014662
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.980  -1.319   0.342  0.00  0.00    +0.145 C 
ENDROOT
BRANCH   1   2
ATOM      2  O   LIG    1        0.726  -0.929  -1.013  0.00  0.00    -0.389 OA
ATOM      3  H   LIG    1       -0.247  -0.824  -1.105  0.00  0.00    +0.210 HD
ENDBRANCH   1   2
BRANCH   1   4
ATOM      4  C   LIG    1        0.009  -2.454   0.744  0.00  0.00    +0.136 C 
BRANCH   4   6
ATOM      5  C   LIG    1       -2.191  -1.339   0.367  0.00  0.00    +0.214 C 
ATOM      6  N   LIG    1       -1.295  -1.976   1.195  0.00  0.00    -0.313 N 
ATOM      7  H   LIG    1       -1.635  -2.308   2.091  0.00  0.00    +0.149 HD
ATOM      8  O   LIG    1       -1.921  -1.019  -0.786  0.00  0.00    -0.276 OA
BRANCH   5   9
ATOM      9  C   LIG    1       -3.519  -1.058   1.029  0.00  0.00    +0.103 C 
BRANCH   9  10
ATOM     10  C   LIG    1       -4.472  -0.341   0.079  0.00  0.00    +0.083 C 
BRANCH  10  13
ATOM     11  C   LIG    1       -6.792   1.116  -1.269  0.00  0.00    +0.150 C 
ATOM     12  N   LIG    1       -6.816   0.602   0.079  0.00  0.00    -0.337 N 
ATOM     13  C   LIG    1       -5.793  -0.059   0.719  0.00  0.00    +0.110 A 
ATOM     14  N   LIG    1       -6.157  -0.390   1.944  0.00  0.00    -0.241 NA
ATOM     15  C   LIG    1       -7.439   0.068   2.092  0.00  0.00    +0.130 A 
ATOM     16  C   LIG    1       -7.869   0.688   0.945  0.00  0.00    +0.106 A 
ENDBRANCH  10  13
ENDBRANCH   9  10
ENDBRANCH   5   9
ENDBRANCH   4   6
ENDBRANCH   1   4
BRANCH   1  17
ATOM     17  C   LIG    1        2.446  -1.809   0.463  0.00  0.00    +0.117 C 
BRANCH  17  18
ATOM     18  N   LIG    1        3.538  -0.821   0.397  0.00  0.00    -0.295 NA
ATOM     19  C   LIG    1        3.614  -0.137  -0.905  0.00  0.00    +0.120 C 
ATOM     20  C   LIG    1        4.764   0.851  -0.977  0.00  0.00    -0.030 A 
ATOM     21  C   LIG    1        5.310   1.404   0.196  0.00  0.00    -0.042 A 
ATOM     22  C   LIG    1        6.345   2.345   0.105  0.00  0.00    +0.004 A 
ATOM     23  C   LIG    1        6.816   2.754  -1.142  0.00  0.00    +0.000 A 
ATOM     24  C   LIG    1        6.263   2.224  -2.306  0.00  0.00    +0.000 A 
ATOM     25  C   LIG    1        4.828   0.933   1.545  0.00  0.00    +0.051 C 
ATOM     26  C   LIG    1        5.239   1.280  -2.225  0.00  0.00    +0.005 A 
ATOM     27  C   LIG    1        3.494   0.173   1.474  0.00  0.00    +0.089 C 
ENDBRANCH  17  18
ENDBRANCH   1  17
TORSDOF 8