REMARK  Name = BDB060517
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.216  -0.136   0.932  0.00  0.00    +0.097 C 
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1       -1.771   1.214   0.447  0.00  0.00    -0.034 A 
ATOM      3  C   LIG    1       -1.185   1.935  -0.610  0.00  0.00    +0.007 A 
ATOM      4  C   LIG    1       -1.734   3.148  -1.032  0.00  0.00    +0.038 A 
ATOM      5  C   LIG    1       -2.873   3.641  -0.410  0.00  0.00    +0.123 A 
ATOM      6  F   LIG    1       -3.399   4.803  -0.819  0.00  0.00    -0.205 F 
ATOM      7  C   LIG    1       -3.478   2.945   0.628  0.00  0.00    +0.038 A 
ATOM      8  C   LIG    1       -2.931   1.733   1.055  0.00  0.00    +0.007 A 
ENDBRANCH   1   2
BRANCH   1  12
ATOM      9  C   LIG    1        3.106  -0.353   0.627  0.00  0.00    +0.132 A 
ATOM     10  C   LIG    1        2.337  -1.181  -0.185  0.00  0.00    +0.046 A 
ATOM     11  C   LIG    1        0.944  -1.129  -0.097  0.00  0.00    +0.008 A 
ATOM     12  C   LIG    1        0.311  -0.264   0.813  0.00  0.00    -0.034 A 
ATOM     13  C   LIG    1        1.121   0.543   1.641  0.00  0.00    +0.008 A 
ATOM     14  C   LIG    1        2.513   0.495   1.555  0.00  0.00    +0.046 A 
BRANCH   9  15
ATOM     15  O   LIG    1        4.500  -0.418   0.585  0.00  0.00    -0.426 OA
BRANCH  15  17
ATOM     16  C   LIG    1        6.548   0.038  -0.470  0.00  0.00    +0.136 C 
ATOM     17  C   LIG    1        5.056   0.178  -0.541  0.00  0.00    +0.309 C 
ATOM     18  O   LIG    1        4.461   0.734  -1.455  0.00  0.00    -0.251 OA
ENDBRANCH  15  17
ENDBRANCH   9  15
ENDBRANCH   1  12
BRANCH   1  19
ATOM     19  C   LIG    1       -2.022  -1.331   0.410  0.00  0.00    +0.053 A 
ATOM     20  N   LIG    1       -2.334  -2.298   1.315  0.00  0.00    -0.259 NA
ATOM     21  C   LIG    1       -3.036  -3.367   0.880  0.00  0.00    +0.111 A 
ATOM     22  C   LIG    1       -3.455  -3.533  -0.428  0.00  0.00    +0.020 A 
ATOM     23  C   LIG    1       -3.134  -2.544  -1.347  0.00  0.00    +0.003 A 
ATOM     24  C   LIG    1       -2.409  -1.431  -0.929  0.00  0.00    +0.024 A 
ENDBRANCH   1  19
TORSDOF 5