REMARK  Name = BDB040603
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.423  -0.719   1.755  0.00  0.00    +0.139 C 
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1       -1.050  -0.407   1.727  0.00  0.00    -0.026 A 
ATOM      3  C   LIG    1       -1.522   0.877   2.026  0.00  0.00    +0.025 A 
ATOM      4  C   LIG    1       -2.892   1.173   1.971  0.00  0.00    +0.048 A 
ATOM      5 CL   LIG    1       -3.355   2.798   2.339  0.00  0.00    -0.083 Cl
ATOM      6  C   LIG    1       -3.828   0.190   1.616  0.00  0.00    +0.018 A 
ATOM      7  C   LIG    1       -3.331  -1.084   1.302  0.00  0.00    +0.129 A 
ATOM      8  F   LIG    1       -4.181  -2.053   0.930  0.00  0.00    -0.205 F 
ATOM      9  C   LIG    1       -1.972  -1.386   1.349  0.00  0.00    +0.044 A 
BRANCH   6  10
ATOM     10  C   LIG    1       -5.324   0.446   1.551  0.00  0.00    +0.110 C 
ATOM     11  C   LIG    1       -6.116  -0.535   2.418  0.00  0.00    +0.227 C 
ATOM     12  O   LIG    1       -5.739  -0.907   3.527  0.00  0.00    -0.275 OA
ATOM     13  N   LIG    1       -7.344  -0.924   1.940  0.00  0.00    -0.256 N 
ATOM     14  H   LIG    1       -7.861  -1.562   2.530  0.00  0.00    +0.157 HD
ATOM     15  C   LIG    1       -8.041  -0.391   0.885  0.00  0.00    +0.219 C 
ATOM     16  O   LIG    1       -9.209  -0.704   0.672  0.00  0.00    -0.275 OA
ATOM     17  C   LIG    1       -7.324   0.654   0.068  0.00  0.00    +0.097 C 
ATOM     18  C   LIG    1       -5.821   0.428   0.100  0.00  0.00    +0.027 C 
ENDBRANCH   6  10
ENDBRANCH   1   2
BRANCH   1  20
ATOM     19  C   LIG    1        1.223  -1.417  -0.480  0.00  0.00    +0.225 C 
ATOM     20  N   LIG    1        1.021  -0.441   0.472  0.00  0.00    -0.310 N 
ATOM     21  H   LIG    1        1.251   0.522   0.245  0.00  0.00    +0.149 HD
ATOM     22  O   LIG    1        0.968  -2.602  -0.272  0.00  0.00    -0.275 OA
BRANCH  19  23
ATOM     23  C   LIG    1        1.785  -0.910  -1.824  0.00  0.00    +0.085 C 
ATOM     24  C   LIG    1        1.968  -2.095  -2.799  0.00  0.00    +0.027 C 
ATOM     25  C   LIG    1        0.741   0.032  -2.465  0.00  0.00    +0.027 C 
BRANCH  23  29
ATOM     26  C   LIG    1        5.455   1.043  -1.012  0.00  0.00    +0.233 A 
ATOM     27  N   LIG    1        5.472  -0.306  -1.015  0.00  0.00    -0.218 NA
ATOM     28  C   LIG    1        4.286  -0.903  -1.291  0.00  0.00    +0.139 A 
ATOM     29  C   LIG    1        3.111  -0.198  -1.566  0.00  0.00    +0.074 A 
ATOM     30  N   LIG    1        3.106   1.163  -1.529  0.00  0.00    -0.252 NA
ATOM     31  C   LIG    1        4.296   1.760  -1.259  0.00  0.00    +0.178 A 
BRANCH  26  32
ATOM     32  O   LIG    1        6.602   1.757  -0.742  0.00  0.00    -0.476 OA
BRANCH  32  34
ATOM     33  C   LIG    1        8.925   1.826  -0.207  0.00  0.00    +0.048 C 
ATOM     34  C   LIG    1        7.738   0.925  -0.499  0.00  0.00    +0.227 C 
ENDBRANCH  32  34
ENDBRANCH  26  32
ENDBRANCH  23  29
ENDBRANCH  19  23
ENDBRANCH   1  20
TORSDOF 7