REMARK  Name = BDB003683
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        0.127  -1.476   1.254  0.00  0.00    -0.134 NA
ATOM      2  N   LIG    1        1.044  -1.373   0.410  0.00  0.00    -0.181 NA
ENDROOT
BRANCH   1   7
ATOM      3  C   LIG    1       -1.725   1.647   0.882  0.00  0.00    +0.128 A 
ATOM      4  N   LIG    1       -2.913   1.135   0.515  0.00  0.00    -0.199 NA
ATOM      5  C   LIG    1       -3.063  -0.196   0.389  0.00  0.00    +0.221 A 
ATOM      6  N   LIG    1       -2.066  -1.054   0.619  0.00  0.00    -0.193 NA
ATOM      7  C   LIG    1       -0.887  -0.536   0.992  0.00  0.00    +0.181 A 
ATOM      8  C   LIG    1       -0.669   0.812   1.156  0.00  0.00    +0.093 A 
BRANCH   3  10
ATOM      9  C   LIG    1       -2.835   3.776   0.876  0.00  0.00    +0.130 C 
ATOM     10  N   LIG    1       -1.577   3.044   1.025  0.00  0.00    -0.321 N 
ATOM     11  C   LIG    1       -0.460   3.598   0.259  0.00  0.00    +0.130 C 
ENDBRANCH   3  10
BRANCH   5  12
ATOM     12  N   LIG    1       -4.316  -0.698   0.025  0.00  0.00    -0.306 N 
ATOM     13  C   LIG    1       -4.292  -2.051  -0.507  0.00  0.00    +0.132 C 
ATOM     14  C   LIG    1       -5.172   0.261  -0.654  0.00  0.00    +0.132 C 
ENDBRANCH   5  12
ENDBRANCH   1   7
BRANCH   2  15
ATOM     15  C   LIG    1        2.124  -2.338   0.649  0.00  0.00    +0.202 C 
BRANCH  15  16
ATOM     16  C   LIG    1        3.320  -2.054  -0.239  0.00  0.00    -0.013 A 
ATOM     17  C   LIG    1        4.075  -0.861  -0.132  0.00  0.00    +0.060 A 
ATOM     18  C   LIG    1        5.158  -0.660  -1.011  0.00  0.00    +0.013 A 
ATOM     19  C   LIG    1        5.498  -1.618  -1.966  0.00  0.00    +0.001 A 
ATOM     20  C   LIG    1        4.762  -2.792  -2.062  0.00  0.00    +0.000 A 
ATOM     21  C   LIG    1        3.680  -3.009  -1.209  0.00  0.00    +0.006 A 
BRANCH  17  22
ATOM     22  C   LIG    1        3.742   0.227   0.869  0.00  0.00    +0.418 C 
ATOM     23  F   LIG    1        2.687   1.000   0.484  0.00  0.00    -0.166 F 
ATOM     24  F   LIG    1        3.433  -0.247   2.107  0.00  0.00    -0.166 F 
ATOM     25  F   LIG    1        4.772   1.100   1.069  0.00  0.00    -0.166 F 
ENDBRANCH  17  22
ENDBRANCH  15  16
ENDBRANCH   2  15
TORSDOF 6