REMARK  Name = BDB003515
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.754  -0.689  -0.360  0.00  0.00    +0.050 C 
ENDROOT
BRANCH   1   6
ATOM      2  C   LIG    1        5.351   0.455   0.262  0.00  0.00    +0.056 A 
ATOM      3  C   LIG    1        5.356   1.688  -0.411  0.00  0.00    +0.024 A 
ATOM      4  C   LIG    1        4.204   2.166  -1.055  0.00  0.00    +0.056 A 
ATOM      5  C   LIG    1        3.042   1.379  -1.039  0.00  0.00    +0.016 A 
ATOM      6  C   LIG    1        3.019   0.139  -0.386  0.00  0.00    -0.045 A 
ATOM      7  C   LIG    1        4.176  -0.313   0.263  0.00  0.00    +0.016 A 
BRANCH   2   9
ATOM      8  F   LIG    1        7.381  -0.788   0.097  0.00  0.00    -0.166 F 
ATOM      9  C   LIG    1        6.601  -0.057   0.939  0.00  0.00    +0.417 C 
ATOM     10  F   LIG    1        6.339  -0.865   2.004  0.00  0.00    -0.166 F 
ATOM     11  F   LIG    1        7.395   0.941   1.415  0.00  0.00    -0.166 F 
ENDBRANCH   2   9
BRANCH   4  12
ATOM     12  C   LIG    1        4.222   3.486  -1.788  0.00  0.00    +0.417 C 
ATOM     13  F   LIG    1        4.566   3.346  -3.097  0.00  0.00    -0.166 F 
ATOM     14  F   LIG    1        5.108   4.376  -1.261  0.00  0.00    -0.166 F 
ATOM     15  F   LIG    1        3.015   4.118  -1.782  0.00  0.00    -0.166 F 
ENDBRANCH   4  12
ENDBRANCH   1   6
BRANCH   1  16
ATOM     16  C   LIG    1        0.888  -0.361   0.869  0.00  0.00    +0.089 C 
BRANCH  16  17
ATOM     17  N   LIG    1       -0.384  -1.108   0.857  0.00  0.00    -0.297 NA
ATOM     18  C   LIG    1       -1.421  -0.419   1.678  0.00  0.00    +0.071 C 
ATOM     19  C   LIG    1       -2.438  -1.406   2.315  0.00  0.00    +0.099 C 
ATOM     20  N   LIG    1       -1.815  -2.364   3.245  0.00  0.00    -0.313 NA
ATOM     21  H   LIG    1       -2.414  -3.185   3.312  0.00  0.00    +0.122 HD
ATOM     22  C   LIG    1       -0.475  -2.760   2.789  0.00  0.00    +0.096 C 
ATOM     23  C   LIG    1       -0.206  -2.512   1.289  0.00  0.00    +0.100 C 
BRANCH  18  24
ATOM     24  C   LIG    1       -2.139   0.668   0.839  0.00  0.00    +0.023 C 
BRANCH  24  25
ATOM     25  C   LIG    1       -2.890   0.154  -0.413  0.00  0.00    -0.009 C 
ATOM     26  C   LIG    1       -4.407   0.075  -0.166  0.00  0.00    +0.003 C 
ATOM     27  C   LIG    1       -5.160  -0.389  -1.412  0.00  0.00    +0.000 C 
ATOM     28  C   LIG    1       -4.860   0.502  -2.613  0.00  0.00    +0.000 C 
ATOM     29  C   LIG    1       -3.360   0.612  -2.867  0.00  0.00    +0.000 C 
ATOM     30  C   LIG    1       -2.609   1.069  -1.619  0.00  0.00    +0.003 C 
ENDBRANCH  24  25
ENDBRANCH  18  24
ENDBRANCH  16  17
ENDBRANCH   1  16
TORSDOF 7