REMARK  Name = BDB017637
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.746  -1.806   0.019  0.00  0.00    +0.119 C 
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1       -2.103  -1.134   0.067  0.00  0.00    -0.031 A 
ATOM      3  C   LIG    1       -2.775  -0.788  -1.113  0.00  0.00    +0.031 A 
ATOM      4  C   LIG    1       -4.034  -0.183  -1.058  0.00  0.00    +0.051 A 
ATOM      5  C   LIG    1       -4.672   0.068   0.166  0.00  0.00    +0.020 A 
ATOM      6  C   LIG    1       -6.016   0.694   0.152  0.00  0.00    +0.045 A 
ATOM      7  N   LIG    1       -6.706   0.866   1.351  0.00  0.00    -0.343 N 
ATOM      8  H   LIG    1       -6.477   0.161   2.047  0.00  0.00    +0.146 HD
ATOM      9  C   LIG    1       -8.120   1.226   1.352  0.00  0.00    +0.102 C 
ATOM     10  C   LIG    1       -8.379   2.263   0.266  0.00  0.00    +0.023 C 
ATOM     11  C   LIG    1       -7.899   1.752  -1.097  0.00  0.00    +0.044 C 
ATOM     12  C   LIG    1       -6.555   1.078  -1.023  0.00  0.00    +0.038 A 
ATOM     13  C   LIG    1       -5.859   0.829  -2.314  0.00  0.00    +0.254 A 
ATOM     14  O   LIG    1       -6.350   1.161  -3.389  0.00  0.00    -0.268 OA
ATOM     15  C   LIG    1       -3.988  -0.271   1.343  0.00  0.00    +0.012 A 
ATOM     16  N   LIG    1       -4.653   0.193  -2.253  0.00  0.00    -0.322 N 
ATOM     17  H   LIG    1       -4.192   0.035  -3.139  0.00  0.00    +0.169 HD
ATOM     18  C   LIG    1       -2.724  -0.871   1.294  0.00  0.00    +0.005 A 
ENDBRANCH   1   2
BRANCH   1  22
ATOM     19  N   LIG    1        3.057  -0.209  -0.774  0.00  0.00    -0.313 N 
ATOM     20  C   LIG    1        2.607  -1.262  -1.696  0.00  0.00    +0.122 C 
ATOM     21  C   LIG    1        1.367  -2.002  -1.143  0.00  0.00    +0.103 C 
ATOM     22  N   LIG    1        0.211  -1.123  -0.864  0.00  0.00    -0.295 NA
ATOM     23  C   LIG    1        0.654   0.186  -0.323  0.00  0.00    +0.103 C 
ATOM     24  C   LIG    1        2.090   0.218   0.248  0.00  0.00    +0.122 C 
BRANCH  19  28
ATOM     25  C   LIG    1        7.084   0.118   0.270  0.00  0.00    +0.055 A 
ATOM     26  C   LIG    1        6.043   0.365   1.148  0.00  0.00    +0.126 A 
ATOM     27  N   LIG    1        4.730   0.250   0.824  0.00  0.00    -0.240 NA
ATOM     28  C   LIG    1        4.399  -0.113  -0.438  0.00  0.00    +0.121 A 
ATOM     29  C   LIG    1        5.399  -0.337  -1.387  0.00  0.00    +0.044 A 
ATOM     30  C   LIG    1        6.746  -0.224  -1.034  0.00  0.00    +0.018 A 
BRANCH  25  34
ATOM     31  C   LIG    1       10.184   0.051   2.431  0.00  0.00    +0.128 C 
ATOM     32  N   LIG    1        8.810   0.052   1.992  0.00  0.00    -0.314 N 
ATOM     33  H   LIG    1        8.133  -0.400   2.592  0.00  0.00    +0.149 HD
ATOM     34  C   LIG    1        8.508   0.245   0.658  0.00  0.00    +0.245 C 
ATOM     35  O   LIG    1        9.354   0.477  -0.199  0.00  0.00    -0.270 OA
ENDBRANCH  25  34
ENDBRANCH  19  28
ENDBRANCH   1  22
TORSDOF 4