REMARK  Name = BDB002916
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.339  -1.815   0.994  0.00  0.00    +0.084 A 
ATOM      2  C   LIG    1       -1.328  -0.875   0.579  0.00  0.00    +0.083 A 
ATOM      3  C   LIG    1       -1.347   0.569   0.492  0.00  0.00    +0.198 C 
ATOM      4  C   LIG    1       -2.611   1.181  -0.026  0.00  0.00    +0.033 A 
ATOM      5  C   LIG    1       -3.731   0.394  -0.366  0.00  0.00    +0.036 A 
ATOM      6  C   LIG    1       -3.700  -1.093  -0.224  0.00  0.00    +0.229 C 
ATOM      7  O   LIG    1       -4.681  -1.767  -0.511  0.00  0.00    -0.283 OA
ATOM      8  C   LIG    1       -4.896   1.009  -0.844  0.00  0.00    +0.012 A 
ATOM      9  C   LIG    1       -4.945   2.397  -0.984  0.00  0.00    +0.001 A 
ATOM     10  C   LIG    1       -3.838   3.176  -0.647  0.00  0.00    +0.001 A 
ATOM     11  C   LIG    1       -2.673   2.574  -0.169  0.00  0.00    +0.012 A 
ATOM     12  O   LIG    1       -0.400   1.264   0.831  0.00  0.00    -0.286 OA
ATOM     13  C   LIG    1       -2.447  -1.606   0.258  0.00  0.00    +0.187 A 
ATOM     14  O   LIG    1       -2.240  -2.929   0.474  0.00  0.00    -0.446 OA
ATOM     15  C   LIG    1       -0.960  -3.059   0.948  0.00  0.00    +0.220 A 
ENDROOT
BRANCH  15  16
ATOM     16  C   LIG    1       -0.485  -4.429   1.287  0.00  0.00    +0.451 C 
ATOM     17  F   LIG    1       -0.474  -4.655   2.623  0.00  0.00    -0.163 F 
ATOM     18  F   LIG    1        0.773  -4.651   0.825  0.00  0.00    -0.163 F 
ATOM     19  F   LIG    1       -1.266  -5.395   0.734  0.00  0.00    -0.163 F 
ENDBRANCH  15  16
BRANCH   1  20
ATOM     20  C   LIG    1        1.026  -1.623   1.452  0.00  0.00    +0.197 C 
ATOM     21  O   LIG    1        1.445  -2.223   2.436  0.00  0.00    -0.287 OA
BRANCH  20  25
ATOM     22  C   LIG    1        3.760   0.922  -0.668  0.00  0.00    +0.120 A 
ATOM     23  C   LIG    1        2.759   0.241  -1.365  0.00  0.00    +0.046 A 
ATOM     24  C   LIG    1        1.855  -0.589  -0.695  0.00  0.00    +0.015 A 
ATOM     25  C   LIG    1        1.945  -0.732   0.694  0.00  0.00    +0.023 A 
ATOM     26  C   LIG    1        2.960  -0.069   1.393  0.00  0.00    +0.015 A 
ATOM     27  C   LIG    1        3.861   0.761   0.715  0.00  0.00    +0.046 A 
BRANCH  22  29
ATOM     28  C   LIG    1        5.603   2.419  -0.786  0.00  0.00    +0.277 C 
ATOM     29  O   LIG    1        4.572   1.697  -1.449  0.00  0.00    -0.495 OA
ENDBRANCH  22  29
ENDBRANCH  20  25
ENDBRANCH   1  20
TORSDOF 4