REMARK  Name = BDB017710
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.663  -1.341   0.489  0.00  0.00    -0.029 A 
ATOM      2  C   LIG    1        0.920  -0.719  -0.739  0.00  0.00    +0.031 A 
ATOM      3  C   LIG    1        2.203  -0.246  -1.036  0.00  0.00    +0.054 A 
ATOM      4  C   LIG    1        3.263  -0.375  -0.126  0.00  0.00    +0.055 A 
ATOM      5  C   LIG    1        4.590   0.162  -0.505  0.00  0.00    +0.048 A 
ATOM      6  N   LIG    1        5.646   0.074   0.391  0.00  0.00    -0.343 N 
ATOM      7  H   LIG    1        5.509  -0.594   1.150  0.00  0.00    +0.146 HD
ATOM      8  C   LIG    1        7.021   0.283  -0.028  0.00  0.00    +0.102 C 
ATOM      9  C   LIG    1        7.072   1.475  -0.978  0.00  0.00    +0.023 C 
ATOM     10  C   LIG    1        6.091   1.296  -2.144  0.00  0.00    +0.044 C 
ATOM     11  C   LIG    1        4.760   0.735  -1.713  0.00  0.00    +0.038 A 
ATOM     12  C   LIG    1        3.637   0.843  -2.682  0.00  0.00    +0.254 A 
ATOM     13  O   LIG    1        3.781   1.342  -3.793  0.00  0.00    -0.268 OA
ATOM     14  C   LIG    1        2.991  -1.012   1.091  0.00  0.00    +0.135 A 
ATOM     15  F   LIG    1        3.962  -1.198   2.001  0.00  0.00    -0.205 F 
ATOM     16  N   LIG    1        2.425   0.359  -2.278  0.00  0.00    -0.322 N 
ATOM     17  H   LIG    1        1.676   0.446  -2.951  0.00  0.00    +0.169 HD
ATOM     18  C   LIG    1        1.717  -1.490   1.399  0.00  0.00    +0.044 A 
ENDROOT
BRANCH   1  19
ATOM     19  C   LIG    1       -0.721  -1.861   0.820  0.00  0.00    +0.119 C 
BRANCH  19  23
ATOM     20  N   LIG    1       -3.638  -0.388   0.782  0.00  0.00    -0.313 N 
ATOM     21  C   LIG    1       -3.856  -1.163   2.017  0.00  0.00    +0.122 C 
ATOM     22  C   LIG    1       -2.572  -1.958   2.381  0.00  0.00    +0.103 C 
ATOM     23  N   LIG    1       -1.272  -1.302   2.069  0.00  0.00    -0.295 NA
ATOM     24  C   LIG    1       -1.494   0.160   1.974  0.00  0.00    +0.103 C 
ATOM     25  C   LIG    1       -2.552   0.612   0.931  0.00  0.00    +0.122 C 
BRANCH  20  28
ATOM     26  C   LIG    1       -3.929   0.144  -2.075  0.00  0.00    +0.047 C 
ATOM     27  C   LIG    1       -4.967   0.513  -1.055  0.00  0.00    -0.011 A 
ATOM     28  C   LIG    1       -4.816   0.230   0.314  0.00  0.00    +0.124 A 
ATOM     29  N   LIG    1       -5.781   0.547   1.210  0.00  0.00    -0.240 NA
ATOM     30  C   LIG    1       -6.891   1.173   0.766  0.00  0.00    +0.113 A 
ATOM     31  C   LIG    1       -7.107   1.514  -0.554  0.00  0.00    +0.020 A 
ATOM     32  C   LIG    1       -6.127   1.179  -1.476  0.00  0.00    +0.008 A 
ENDBRANCH  20  28
ENDBRANCH  19  23
ENDBRANCH   1  19
TORSDOF 3