REMARK  Name = BDB004057
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  F   LIG    1        4.463  -2.595  -3.095  0.00  0.00    -0.200 F 
ATOM      2  C   LIG    1        3.548  -1.944  -2.363  0.00  0.00    +0.181 A 
ATOM      3  C   LIG    1        3.905  -1.049  -1.370  0.00  0.00    +0.164 A 
ATOM      4  N   LIG    1        2.963  -0.411  -0.643  0.00  0.00    -0.196 NA
ATOM      5  C   LIG    1        1.666  -0.670  -0.892  0.00  0.00    +0.221 A 
ATOM      6  N   LIG    1        1.256  -1.528  -1.838  0.00  0.00    -0.220 NA
ATOM      7  C   LIG    1        2.209  -2.150  -2.558  0.00  0.00    +0.156 A 
ENDROOT
BRANCH   3   8
ATOM      8  N   LIG    1        5.283  -0.794  -1.166  0.00  0.00    -0.296 N 
ATOM      9  H   LIG    1        5.823  -1.655  -1.244  0.00  0.00    +0.154 HD
BRANCH   8  10
ATOM     10  C   LIG    1        5.906   0.129  -0.293  0.00  0.00    +0.051 A 
ATOM     11  C   LIG    1        7.192  -0.139   0.222  0.00  0.00    +0.062 A 
ATOM     12 CL   LIG    1        7.997  -1.626  -0.153  0.00  0.00    -0.082 Cl
ATOM     13  C   LIG    1        7.847   0.772   1.056  0.00  0.00    +0.022 A 
ATOM     14  C   LIG    1        7.235   1.981   1.379  0.00  0.00    +0.002 A 
ATOM     15  C   LIG    1        5.976   2.276   0.863  0.00  0.00    +0.002 A 
ATOM     16  C   LIG    1        5.323   1.361   0.029  0.00  0.00    +0.025 A 
ENDBRANCH   8  10
ENDBRANCH   3   8
BRANCH   5  17
ATOM     17  N   LIG    1        0.771   0.023  -0.084  0.00  0.00    -0.284 N 
ATOM     18  H   LIG    1        1.292   0.588   0.571  0.00  0.00    +0.155 HD
BRANCH  17  19
ATOM     19  C   LIG    1       -0.622   0.063   0.017  0.00  0.00    +0.034 A 
ATOM     20  C   LIG    1       -1.489  -0.663  -0.796  0.00  0.00    +0.025 A 
ATOM     21  C   LIG    1       -2.883  -0.572  -0.643  0.00  0.00    +0.025 A 
ATOM     22  C   LIG    1       -3.479   0.244   0.328  0.00  0.00    +0.030 A 
ATOM     23  C   LIG    1       -2.598   0.970   1.139  0.00  0.00    +0.025 A 
ATOM     24  C   LIG    1       -1.204   0.884   0.988  0.00  0.00    +0.025 A 
BRANCH  22  25
ATOM     25  N   LIG    1       -4.850   0.331   0.475  0.00  0.00    -0.326 N 
ATOM     26  C   LIG    1       -5.779  -0.093  -0.585  0.00  0.00    +0.133 C 
ATOM     27  C   LIG    1       -7.112   0.664  -0.451  0.00  0.00    +0.178 C 
ATOM     28  O   LIG    1       -7.774   0.470   0.807  0.00  0.00    -0.377 OA
ATOM     29  C   LIG    1       -6.870   0.190   1.885  0.00  0.00    +0.178 C 
ATOM     30  C   LIG    1       -5.476   0.817   1.715  0.00  0.00    +0.133 C 
ENDBRANCH  22  25
ENDBRANCH  17  19
ENDBRANCH   5  17
TORSDOF 5