REMARK  Name = BDB063372
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.221  -1.395  -0.631  0.00  0.00    +0.099 C 
ATOM      2  C   LIG    1       -0.045  -0.594  -0.860  0.00  0.00    +0.227 C 
ATOM      3  O   LIG    1        0.006   0.395  -1.591  0.00  0.00    -0.284 OA
ATOM      4  C   LIG    1       -1.297  -1.007  -0.193  0.00  0.00    +0.125 A 
ATOM      5  C   LIG    1       -1.298  -2.061   0.689  0.00  0.00    +0.053 A 
ATOM      6  C   LIG    1       -2.504  -2.403   1.298  0.00  0.00    +0.017 A 
ATOM      7  C   LIG    1       -3.653  -1.673   0.994  0.00  0.00    +0.044 A 
ATOM      8  C   LIG    1       -3.576  -0.610   0.097  0.00  0.00    +0.122 A 
ATOM      9  C   LIG    1       -0.069  -2.795   0.983  0.00  0.00    +0.208 C 
ATOM     10  O   LIG    1       -0.099  -3.689   1.822  0.00  0.00    -0.286 OA
ATOM     11  N   LIG    1       -2.408  -0.284  -0.496  0.00  0.00    -0.228 NA
ATOM     12  C   LIG    1        1.169  -2.420   0.242  0.00  0.00    +0.113 C 
ATOM     13 CL   LIG    1        2.531  -3.437   0.586  0.00  0.00    -0.078 Cl
ENDROOT
BRANCH   8  14
ATOM     14  N   LIG    1       -4.726   0.124  -0.233  0.00  0.00    -0.310 N 
ATOM     15  C   LIG    1       -5.831   0.433   0.625  0.00  0.00    +0.139 C 
ATOM     16  C   LIG    1       -6.179   1.570  -0.358  0.00  0.00    +0.149 C 
ATOM     17  C   LIG    1       -4.707   1.448  -0.797  0.00  0.00    +0.139 C 
BRANCH  16  18
ATOM     18  O   LIG    1       -6.590   2.829   0.218  0.00  0.00    -0.389 OA
ATOM     19  H   LIG    1       -7.517   2.695   0.479  0.00  0.00    +0.210 HD
ENDBRANCH  16  18
ENDBRANCH   8  14
BRANCH   1  20
ATOM     20  N   LIG    1        2.282  -0.918  -1.409  0.00  0.00    -0.337 N 
ATOM     21  H   LIG    1        1.990  -0.098  -1.957  0.00  0.00    +0.146 HD
BRANCH  20  22
ATOM     22  C   LIG    1        3.725  -1.033  -1.234  0.00  0.00    +0.141 C 
BRANCH  22  23
ATOM     23  C   LIG    1        4.255  -0.324   0.023  0.00  0.00    +0.214 C 
ATOM     24  F   LIG    1        5.403  -0.979   0.401  0.00  0.00    -0.241 F 
BRANCH  23  26
ATOM     25  C   LIG    1        3.455   2.019  -0.637  0.00  0.00    +0.044 C 
ATOM     26  C   LIG    1        4.630   1.164  -0.162  0.00  0.00    +0.093 C 
ATOM     27  C   LIG    1        5.176   1.732   1.155  0.00  0.00    +0.044 C 
BRANCH  26  28
ATOM     28  O   LIG    1        5.670   1.282  -1.143  0.00  0.00    -0.386 OA
ATOM     29  H   LIG    1        6.413   0.728  -0.836  0.00  0.00    +0.210 HD
ENDBRANCH  26  28
ENDBRANCH  23  26
ENDBRANCH  22  23
ENDBRANCH  20  22
ENDBRANCH   1  20
TORSDOF 7