REMARK  Name = BDB019730
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.340   0.853  -2.429  0.00  0.00    +0.037 A 
ATOM      2  C   LIG    1       -0.709  -0.044  -1.415  0.00  0.00    +0.021 A 
ATOM      3  C   LIG    1       -2.067  -0.308  -1.157  0.00  0.00    +0.006 A 
ATOM      4  C   LIG    1       -3.035   0.350  -1.921  0.00  0.00    +0.128 A 
ATOM      5  F   LIG    1       -4.337   0.117  -1.700  0.00  0.00    -0.205 F 
ATOM      6  C   LIG    1       -2.680   1.253  -2.919  0.00  0.00    +0.039 A 
ATOM      7  C   LIG    1       -1.331   1.509  -3.170  0.00  0.00    +0.016 A 
ENDROOT
BRANCH   1   9
ATOM      8  O   LIG    1        1.388   2.273  -3.166  0.00  0.00    -0.270 OA
ATOM      9  C   LIG    1        1.084   1.169  -2.729  0.00  0.00    +0.244 C 
ATOM     10  N   LIG    1        1.999   0.167  -2.504  0.00  0.00    -0.306 N 
ATOM     11  H   LIG    1        1.725  -0.715  -2.098  0.00  0.00    +0.149 HD
BRANCH  10  12
ATOM     12  C   LIG    1        3.424   0.412  -2.599  0.00  0.00    +0.160 C 
BRANCH  12  13
ATOM     13  C   LIG    1        3.999   0.772  -1.248  0.00  0.00    +0.058 A 
ATOM     14  N   LIG    1        4.380  -0.254  -0.441  0.00  0.00    -0.257 NA
ATOM     15  C   LIG    1        4.859   0.072   0.785  0.00  0.00    +0.131 A 
ATOM     16  C   LIG    1        4.965   1.371   1.255  0.00  0.00    +0.059 A 
ATOM     17 CL   LIG    1        5.582   1.697   2.822  0.00  0.00    -0.082 Cl
ATOM     18  C   LIG    1        4.554   2.407   0.425  0.00  0.00    +0.023 A 
ATOM     19  C   LIG    1        4.059   2.106  -0.843  0.00  0.00    +0.026 A 
ENDBRANCH  12  13
ENDBRANCH  10  12
ENDBRANCH   1   9
BRANCH   3  20
ATOM     20  C   LIG    1       -2.475  -1.253  -0.059  0.00  0.00    +0.142 C 
BRANCH  20  21
ATOM     21  N   LIG    1       -2.350  -0.598   1.228  0.00  0.00    -0.313 N 
ATOM     22  H   LIG    1       -1.497  -0.056   1.322  0.00  0.00    +0.149 HD
BRANCH  21  23
ATOM     23  C   LIG    1       -2.595  -1.247   2.385  0.00  0.00    +0.176 C 
ATOM     24  N   LIG    1       -3.669  -2.076   2.434  0.00  0.00    -0.316 N 
ATOM     25  H   LIG    1       -4.481  -1.698   1.960  0.00  0.00    +0.149 HD
ATOM     26  C   LIG    1       -3.880  -2.402   3.830  0.00  0.00    +0.127 C 
ATOM     27  C   LIG    1       -2.535  -2.001   4.446  0.00  0.00    +0.163 C 
ATOM     28  N   LIG    1       -1.879  -1.097   3.461  0.00  0.00    -0.255 NA
ENDBRANCH  21  23
ENDBRANCH  20  21
ENDBRANCH   3  20
TORSDOF 6