REMARK  Name = BDB019713
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.089   1.413  -0.245  0.00  0.00    +0.037 A 
ATOM      2  C   LIG    1       -1.305   1.560  -0.199  0.00  0.00    +0.021 A 
ATOM      3  C   LIG    1       -2.029   1.921  -1.349  0.00  0.00    +0.006 A 
ATOM      4  C   LIG    1       -1.315   2.178  -2.522  0.00  0.00    +0.128 A 
ATOM      5  F   LIG    1       -1.965   2.572  -3.627  0.00  0.00    -0.205 F 
ATOM      6  C   LIG    1        0.072   2.055  -2.576  0.00  0.00    +0.039 A 
ATOM      7  C   LIG    1        0.779   1.670  -1.436  0.00  0.00    +0.016 A 
ENDROOT
BRANCH   1   9
ATOM      8  O   LIG    1        0.337   1.282   2.099  0.00  0.00    -0.270 OA
ATOM      9  C   LIG    1        0.800   1.007   0.999  0.00  0.00    +0.244 C 
ATOM     10  N   LIG    1        1.964   0.289   0.825  0.00  0.00    -0.307 N 
ATOM     11  H   LIG    1        2.130  -0.144  -0.073  0.00  0.00    +0.149 HD
BRANCH  10  12
ATOM     12  C   LIG    1        2.642  -0.269   1.970  0.00  0.00    +0.140 C 
BRANCH  12  13
ATOM     13  C   LIG    1        3.993  -0.806   1.576  0.00  0.00    -0.029 A 
ATOM     14  C   LIG    1        5.073   0.070   1.391  0.00  0.00    +0.026 A 
ATOM     15  C   LIG    1        6.327  -0.414   1.000  0.00  0.00    +0.060 A 
ATOM     16 CL   LIG    1        7.603   0.732   0.794  0.00  0.00    -0.082 Cl
ATOM     17  C   LIG    1        6.507  -1.784   0.786  0.00  0.00    +0.059 A 
ATOM     18 CL   LIG    1        8.023  -2.457   0.301  0.00  0.00    -0.082 Cl
ATOM     19  C   LIG    1        5.433  -2.662   0.961  0.00  0.00    +0.022 A 
ATOM     20  C   LIG    1        4.182  -2.175   1.350  0.00  0.00    +0.007 A 
ENDBRANCH  12  13
ENDBRANCH  10  12
ENDBRANCH   1   9
BRANCH   3  21
ATOM     21  C   LIG    1       -3.526   2.103  -1.349  0.00  0.00    +0.142 C 
BRANCH  21  22
ATOM     22  N   LIG    1       -4.194   1.333  -0.310  0.00  0.00    -0.313 N 
ATOM     23  H   LIG    1       -4.992   1.818   0.080  0.00  0.00    +0.149 HD
BRANCH  22  24
ATOM     24  C   LIG    1       -4.433   0.012  -0.469  0.00  0.00    +0.176 C 
ATOM     25  N   LIG    1       -5.224  -0.514   0.503  0.00  0.00    -0.316 N 
ATOM     26  H   LIG    1       -5.000  -0.168   1.429  0.00  0.00    +0.149 HD
ATOM     27  C   LIG    1       -5.154  -1.955   0.364  0.00  0.00    +0.127 C 
ATOM     28  C   LIG    1       -4.583  -2.100  -1.049  0.00  0.00    +0.163 C 
ATOM     29  N   LIG    1       -3.984  -0.782  -1.392  0.00  0.00    -0.255 NA
ENDBRANCH  22  24
ENDBRANCH  21  22
ENDBRANCH   3  21
TORSDOF 6