REMARK  Name = BDB015099
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1        0.340  -1.430  -1.141  0.00  0.00    -0.489 OA
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1        1.463  -1.741  -0.429  0.00  0.00    +0.121 A 
ATOM      3  C   LIG    1        2.477  -0.778  -0.507  0.00  0.00    +0.054 A 
ATOM      4  C   LIG    1        3.700  -0.936   0.167  0.00  0.00    -0.014 A 
ATOM      5  C   LIG    1        3.882  -2.099   0.929  0.00  0.00    +0.009 A 
ATOM      6  C   LIG    1        2.878  -3.066   1.011  0.00  0.00    +0.004 A 
ATOM      7  C   LIG    1        1.671  -2.888   0.333  0.00  0.00    +0.045 A 
BRANCH   4   8
ATOM      8  C   LIG    1        4.755   0.088   0.077  0.00  0.00    -0.018 A 
ATOM      9  C   LIG    1        6.064  -0.252  -0.297  0.00  0.00    +0.009 A 
ATOM     10  C   LIG    1        7.068   0.719  -0.383  0.00  0.00    +0.013 A 
ATOM     11  C   LIG    1        6.788   2.061  -0.088  0.00  0.00    +0.055 A 
ATOM     12  C   LIG    1        5.482   2.410   0.278  0.00  0.00    +0.013 A 
ATOM     13  C   LIG    1        4.481   1.436   0.361  0.00  0.00    +0.009 A 
BRANCH  11  14
ATOM     14  C   LIG    1        7.863   3.113  -0.201  0.00  0.00    +0.417 C 
ATOM     15  F   LIG    1        7.679   4.160   0.651  0.00  0.00    -0.166 F 
ATOM     16  F   LIG    1        9.111   2.634   0.067  0.00  0.00    -0.166 F 
ATOM     17  F   LIG    1        7.930   3.654  -1.449  0.00  0.00    -0.166 F 
ENDBRANCH  11  14
ENDBRANCH   4   8
ENDBRANCH   1   2
BRANCH   1  18
ATOM     18  C   LIG    1       -0.778  -2.316  -1.102  0.00  0.00    +0.261 C 
BRANCH  18  19
ATOM     19  C   LIG    1       -1.670  -2.081   0.128  0.00  0.00    +0.166 C 
BRANCH  19  20
ATOM     20  O   LIG    1       -2.699  -3.075   0.215  0.00  0.00    -0.387 OA
ATOM     21  H   LIG    1       -2.266  -3.943   0.261  0.00  0.00    +0.210 HD
ENDBRANCH  19  20
BRANCH  19  22
ATOM     22  C   LIG    1       -2.273  -0.653   0.183  0.00  0.00    +0.119 C 
BRANCH  22  23
ATOM     23  N   LIG    1       -2.980  -0.183  -1.029  0.00  0.00    -0.295 NA
ATOM     24  C   LIG    1       -3.336   1.246  -0.915  0.00  0.00    +0.120 C 
ATOM     25  C   LIG    1       -4.542   1.539  -0.045  0.00  0.00    -0.030 A 
ATOM     26  C   LIG    1       -5.509   0.548   0.208  0.00  0.00    -0.042 A 
ATOM     27  C   LIG    1       -6.632   0.856   0.987  0.00  0.00    +0.004 A 
ATOM     28  C   LIG    1       -6.809   2.143   1.492  0.00  0.00    +0.000 A 
ATOM     29  C   LIG    1       -5.864   3.132   1.227  0.00  0.00    +0.000 A 
ATOM     30  C   LIG    1       -5.307  -0.858  -0.302  0.00  0.00    +0.051 C 
ATOM     31  C   LIG    1       -4.737   2.833   0.459  0.00  0.00    +0.005 A 
ATOM     32  C   LIG    1       -4.195  -0.946  -1.358  0.00  0.00    +0.089 C 
ENDBRANCH  22  23
ENDBRANCH  19  22
ENDBRANCH  18  19
ENDBRANCH   1  18
TORSDOF 8