REMARK  Name = BDB063739
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.560   0.568  -1.248  0.00  0.00    +0.135 C 
ENDROOT
BRANCH   1   3
ATOM      2  O   LIG    1        0.968   2.404  -1.667  0.00  0.00    -0.291 OA
ATOM      3  C   LIG    1       -0.090   2.024  -1.165  0.00  0.00    +0.174 C 
BRANCH   3   4
ATOM      4  C   LIG    1       -0.960   3.056  -0.513  0.00  0.00    +0.018 A 
ATOM      5  C   LIG    1       -0.365   4.266  -0.122  0.00  0.00    +0.013 A 
ATOM      6  C   LIG    1       -1.128   5.271   0.480  0.00  0.00    +0.020 A 
ATOM      7  C   LIG    1       -2.490   5.072   0.688  0.00  0.00    +0.041 A 
ATOM      8 CL   LIG    1       -3.433   6.306   1.426  0.00  0.00    -0.084 Cl
ATOM      9  C   LIG    1       -3.095   3.879   0.296  0.00  0.00    +0.020 A 
ATOM     10  C   LIG    1       -2.333   2.872  -0.308  0.00  0.00    +0.013 A 
ENDBRANCH   3   4
ENDBRANCH   1   3
BRANCH   1  11
ATOM     11  C   LIG    1       -0.839  -0.047   0.121  0.00  0.00    +0.177 C 
ATOM     12  O   LIG    1       -0.601   0.552   1.170  0.00  0.00    -0.291 OA
BRANCH  11  13
ATOM     13  C   LIG    1       -1.409  -1.415   0.235  0.00  0.00    +0.056 A 
ATOM     14  C   LIG    1       -2.283  -1.950  -0.713  0.00  0.00    +0.134 A 
ATOM     15  F   LIG    1       -2.678  -1.236  -1.774  0.00  0.00    -0.205 F 
ATOM     16  C   LIG    1       -2.787  -3.243  -0.572  0.00  0.00    +0.042 A 
ATOM     17  C   LIG    1       -2.421  -4.011   0.533  0.00  0.00    +0.041 A 
ATOM     18  C   LIG    1       -1.560  -3.474   1.484  0.00  0.00    +0.124 A 
ATOM     19  F   LIG    1       -1.211  -4.212   2.545  0.00  0.00    -0.205 F 
ATOM     20  C   LIG    1       -1.056  -2.185   1.351  0.00  0.00    +0.052 A 
ENDBRANCH  11  13
ENDBRANCH   1  11
BRANCH   1  21
ATOM     21  C   LIG    1        0.408  -0.296  -2.096  0.00  0.00    +0.054 C 
BRANCH  21  22
ATOM     22  C   LIG    1        1.507  -1.023  -1.349  0.00  0.00    -0.046 A 
ATOM     23  C   LIG    1        2.470  -0.329  -0.602  0.00  0.00    +0.016 A 
ATOM     24  C   LIG    1        3.478  -1.013   0.098  0.00  0.00    +0.055 A 
ATOM     25  C   LIG    1        3.510  -2.413   0.048  0.00  0.00    +0.012 A 
ATOM     26  C   LIG    1        2.571  -3.114  -0.706  0.00  0.00    +0.001 A 
ATOM     27  C   LIG    1        1.581  -2.423  -1.405  0.00  0.00    +0.004 A 
BRANCH  24  28
ATOM     28  C   LIG    1        4.490  -0.255   0.924  0.00  0.00    +0.417 C 
ATOM     29  F   LIG    1        5.702  -0.877   0.978  0.00  0.00    -0.166 F 
ATOM     30  F   LIG    1        4.094  -0.105   2.218  0.00  0.00    -0.166 F 
ATOM     31  F   LIG    1        4.741   1.000   0.459  0.00  0.00    -0.166 F 
ENDBRANCH  24  28
ENDBRANCH  21  22
ENDBRANCH   1  21
TORSDOF 7