REMARK  Name = BDB063377
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -1.084   1.459   0.783  0.00  0.00    -0.334 N 
ATOM      2  H   LIG    1       -1.089   1.287   1.802  0.00  0.00    +0.147 HD
ENDROOT
BRANCH   1   3
ATOM      3  C   LIG    1       -2.209   0.797   0.261  0.00  0.00    +0.099 C 
ATOM      4  C   LIG    1       -2.836  -0.177   1.223  0.00  0.00    +0.227 C 
ATOM      5  O   LIG    1       -2.353  -0.288   2.348  0.00  0.00    -0.284 OA
ATOM      6  C   LIG    1       -4.009  -0.963   0.782  0.00  0.00    +0.123 A 
ATOM      7  C   LIG    1       -4.552  -0.764  -0.470  0.00  0.00    +0.052 A 
ATOM      8  C   LIG    1       -5.662  -1.530  -0.841  0.00  0.00    +0.015 A 
ATOM      9  C   LIG    1       -6.181  -2.462   0.054  0.00  0.00    +0.020 A 
ATOM     10  C   LIG    1       -5.571  -2.594   1.290  0.00  0.00    +0.111 A 
ATOM     11  C   LIG    1       -3.985   0.227  -1.387  0.00  0.00    +0.208 C 
ATOM     12  O   LIG    1       -4.503   0.389  -2.487  0.00  0.00    -0.286 OA
ATOM     13  N   LIG    1       -4.500  -1.868   1.672  0.00  0.00    -0.251 NA
ATOM     14  C   LIG    1       -2.790   0.990  -0.936  0.00  0.00    +0.113 C 
ATOM     15 CL   LIG    1       -2.230   2.203  -2.042  0.00  0.00    -0.078 Cl
ENDBRANCH   1   3
BRANCH   1  18
ATOM     16  C   LIG    1        1.992   0.883  -0.193  0.00  0.00    +0.041 C 
ATOM     17  C   LIG    1        1.482   1.877   0.882  0.00  0.00    +0.051 C 
ATOM     18  C   LIG    1        0.204   1.209   0.311  0.00  0.00    +0.038 C 
ATOM     19  C   LIG    1        0.826   1.401  -1.083  0.00  0.00    +0.051 C 
ATOM     20  C   LIG    1        0.971  -0.132   0.392  0.00  0.00    +0.051 C 
BRANCH  16  22
ATOM     21  C   LIG    1        4.310   0.161   0.243  0.00  0.00    +0.283 C 
ATOM     22  N   LIG    1        3.328   0.648  -0.610  0.00  0.00    -0.305 N 
ATOM     23  H   LIG    1        3.626   0.858  -1.558  0.00  0.00    +0.149 HD
ATOM     24  O   LIG    1        4.088  -0.112   1.421  0.00  0.00    -0.269 OA
BRANCH  21  26
ATOM     25  C   LIG    1        6.759  -0.483   0.511  0.00  0.00    +0.095 C 
ATOM     26  C   LIG    1        5.682  -0.004  -0.437  0.00  0.00    +0.320 C 
ATOM     27  F   LIG    1        5.599  -0.882  -1.482  0.00  0.00    -0.196 F 
ATOM     28  F   LIG    1        6.086   1.175  -0.999  0.00  0.00    -0.196 F 
ENDBRANCH  21  26
ENDBRANCH  16  22
ENDBRANCH   1  18
TORSDOF 4