REMARK  Name = BDB014809
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -0.219  -0.429  -0.093  0.00  0.00    -0.298 N 
ATOM      2  H   LIG    1       -0.536  -1.263  -0.571  0.00  0.00    +0.154 HD
ENDROOT
BRANCH   1   8
ATOM      3  C   LIG    1       -6.958  -1.655  -0.968  0.00  0.00    +0.109 C 
ATOM      4  C   LIG    1       -5.456  -1.768  -1.018  0.00  0.00    +0.213 C 
ATOM      5  N   LIG    1       -4.722  -0.885  -0.235  0.00  0.00    -0.297 N 
ATOM      6  C   LIG    1       -3.260  -1.091  -0.242  0.00  0.00    +0.148 C 
ATOM      7  C   LIG    1       -2.555   0.089   0.323  0.00  0.00    +0.032 A 
ATOM      8  C   LIG    1       -1.171   0.400   0.405  0.00  0.00    +0.150 A 
ATOM      9  N   LIG    1       -0.995   1.575   1.021  0.00  0.00    -0.156 NA
ATOM     10  N   LIG    1       -2.231   2.018   1.306  0.00  0.00    -0.269 N 
ATOM     11  C   LIG    1       -2.383   3.295   1.959  0.00  0.00    +0.172 C 
ATOM     12  C   LIG    1       -3.200   1.147   0.926  0.00  0.00    +0.047 A 
ATOM     13  C   LIG    1       -4.667   1.270   1.077  0.00  0.00    +0.074 C 
ATOM     14  C   LIG    1       -5.299  -0.128   0.899  0.00  0.00    +0.114 C 
ATOM     15  O   LIG    1       -4.923  -2.611  -1.740  0.00  0.00    -0.276 OA
ENDBRANCH   1   8
BRANCH   1  16
ATOM     16  C   LIG    1        1.191  -0.343  -0.103  0.00  0.00    +0.032 A 
ATOM     17  C   LIG    1        1.914   0.692   0.493  0.00  0.00    +0.024 A 
ATOM     18  C   LIG    1        3.316   0.723   0.448  0.00  0.00    +0.010 A 
ATOM     19  C   LIG    1        4.046  -0.285  -0.196  0.00  0.00    -0.018 A 
ATOM     20  C   LIG    1        3.323  -1.326  -0.793  0.00  0.00    +0.010 A 
ATOM     21  C   LIG    1        1.923  -1.353  -0.748  0.00  0.00    +0.024 A 
BRANCH  19  22
ATOM     22  C   LIG    1        5.516  -0.251  -0.243  0.00  0.00    -0.012 A 
ATOM     23  C   LIG    1        6.202   0.895  -0.681  0.00  0.00    +0.047 A 
ATOM     24  C   LIG    1        7.595   0.916  -0.722  0.00  0.00    +0.127 A 
ATOM     25  F   LIG    1        8.222   2.021  -1.146  0.00  0.00    -0.205 F 
ATOM     26  C   LIG    1        8.342  -0.184  -0.335  0.00  0.00    +0.076 A 
ATOM     27  C   LIG    1        7.674  -1.318   0.099  0.00  0.00    +0.127 A 
ATOM     28  F   LIG    1        8.378  -2.392   0.480  0.00  0.00    -0.205 F 
ATOM     29  C   LIG    1        6.282  -1.363   0.148  0.00  0.00    +0.047 A 
ENDBRANCH  19  22
ENDBRANCH   1  16
TORSDOF 3