REMARK  Name = BDB019733
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.698   1.556  -1.359  0.00  0.00    -0.030 A 
ATOM      2  C   LIG    1       -1.480   0.870  -0.414  0.00  0.00    +0.013 A 
ATOM      3  C   LIG    1       -2.372   1.561   0.424  0.00  0.00    +0.005 A 
ATOM      4  C   LIG    1       -2.467   2.947   0.297  0.00  0.00    +0.128 A 
ATOM      5  F   LIG    1       -3.309   3.639   1.078  0.00  0.00    -0.205 F 
ATOM      6  C   LIG    1       -1.694   3.642  -0.628  0.00  0.00    +0.039 A 
ATOM      7  C   LIG    1       -0.807   2.950  -1.453  0.00  0.00    +0.008 A 
ENDROOT
BRANCH   1   8
ATOM      8  C   LIG    1        0.274   0.802  -2.228  0.00  0.00    +0.139 C 
BRANCH   8  10
ATOM      9  C   LIG    1        2.415  -0.361  -2.039  0.00  0.00    +0.244 C 
ATOM     10  N   LIG    1        1.475   0.484  -1.492  0.00  0.00    -0.307 N 
ATOM     11  H   LIG    1        1.750   1.123  -0.758  0.00  0.00    +0.149 HD
ATOM     12  O   LIG    1        2.263  -0.930  -3.114  0.00  0.00    -0.270 OA
BRANCH   9  17
ATOM     13  C   LIG    1        6.124  -0.903   0.084  0.00  0.00    +0.138 A 
ATOM     14  C   LIG    1        4.958  -0.538   0.779  0.00  0.00    +0.083 A 
ATOM     15 CL   LIG    1        4.971  -0.299   2.494  0.00  0.00    -0.080 Cl
ATOM     16  C   LIG    1        3.742  -0.359   0.110  0.00  0.00    +0.036 A 
ATOM     17  C   LIG    1        3.681  -0.535  -1.274  0.00  0.00    +0.038 A 
ATOM     18  C   LIG    1        4.833  -0.914  -1.972  0.00  0.00    +0.017 A 
ATOM     19  C   LIG    1        6.048  -1.093  -1.299  0.00  0.00    +0.048 A 
BRANCH  13  21
ATOM     20  C   LIG    1        8.448  -1.453   0.148  0.00  0.00    +0.277 C 
ATOM     21  O   LIG    1        7.266  -1.051   0.826  0.00  0.00    -0.494 OA
ENDBRANCH  13  21
ENDBRANCH   9  17
ENDBRANCH   8  10
ENDBRANCH   1   8
BRANCH   3  22
ATOM     22  C   LIG    1       -3.224   0.819   1.419  0.00  0.00    +0.142 C 
BRANCH  22  23
ATOM     23  N   LIG    1       -4.369   0.234   0.745  0.00  0.00    -0.313 N 
ATOM     24  H   LIG    1       -4.162  -0.129  -0.176  0.00  0.00    +0.149 HD
BRANCH  23  25
ATOM     25  C   LIG    1       -5.230  -0.544   1.435  0.00  0.00    +0.176 C 
ATOM     26  N   LIG    1       -6.157  -1.159   0.655  0.00  0.00    -0.316 N 
ATOM     27  H   LIG    1       -6.525  -0.557  -0.072  0.00  0.00    +0.149 HD
ATOM     28  C   LIG    1       -7.157  -1.706   1.550  0.00  0.00    +0.127 C 
ATOM     29  C   LIG    1       -6.418  -1.678   2.891  0.00  0.00    +0.163 C 
ATOM     30  N   LIG    1       -5.278  -0.736   2.719  0.00  0.00    -0.255 NA
ENDBRANCH  23  25
ENDBRANCH  22  23
ENDBRANCH   3  22
TORSDOF 7