REMARK  Name = BDB002048
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.156   0.386  -0.199  0.00  0.00    +0.037 A 
ATOM      2  C   LIG    1        0.724   0.197   0.872  0.00  0.00    +0.013 A 
ATOM      3  C   LIG    1        1.952  -0.440   0.671  0.00  0.00    +0.006 A 
ATOM      4  C   LIG    1        2.327  -0.878  -0.608  0.00  0.00    -0.022 A 
ATOM      5  C   LIG    1        1.443  -0.681  -1.678  0.00  0.00    +0.006 A 
ATOM      6  C   LIG    1        0.212  -0.047  -1.478  0.00  0.00    +0.013 A 
ENDROOT
BRANCH   1   8
ATOM      7  O   LIG    1       -1.579   1.820   1.022  0.00  0.00    -0.270 OA
ATOM      8  C   LIG    1       -1.454   1.069   0.061  0.00  0.00    +0.244 C 
ATOM      9  N   LIG    1       -2.487   0.772  -0.805  0.00  0.00    -0.309 N 
ATOM     10  H   LIG    1       -2.422  -0.081  -1.345  0.00  0.00    +0.149 HD
BRANCH   9  11
ATOM     11  C   LIG    1       -3.837   1.236  -0.530  0.00  0.00    +0.136 C 
BRANCH  11  12
ATOM     12  C   LIG    1       -4.552   0.318   0.464  0.00  0.00    +0.135 C 
ATOM     13  O   LIG    1       -4.769  -0.981  -0.135  0.00  0.00    -0.375 OA
ATOM     14  C   LIG    1       -6.070  -1.446   0.258  0.00  0.00    +0.160 C 
ATOM     15  C   LIG    1       -6.610  -0.459   1.271  0.00  0.00    +0.031 C 
ATOM     16  C   LIG    1       -5.929   0.822   0.859  0.00  0.00    +0.035 C 
ENDBRANCH  11  12
ENDBRANCH   9  11
ENDBRANCH   1   8
BRANCH   4  17
ATOM     17  C   LIG    1        3.642  -1.586  -0.824  0.00  0.00    +0.195 C 
BRANCH  17  18
ATOM     18  O   LIG    1        4.710  -0.974  -0.098  0.00  0.00    -0.369 OA
BRANCH  18  19
ATOM     19  C   LIG    1        5.220   0.200  -0.732  0.00  0.00    +0.241 C 
BRANCH  19  20
ATOM     20  C   LIG    1        6.268   0.927   0.113  0.00  0.00    +0.330 C 
ATOM     21  F   LIG    1        6.918   1.803  -0.714  0.00  0.00    -0.197 F 
ATOM     22  F   LIG    1        5.641   1.694   1.047  0.00  0.00    -0.197 F 
BRANCH  20  23
ATOM     23  C   LIG    1        7.287   0.004   0.768  0.00  0.00    +0.412 C 
ATOM     24  F   LIG    1        6.726  -0.822   1.687  0.00  0.00    -0.203 F 
ATOM     25  F   LIG    1        8.223   0.730   1.442  0.00  0.00    -0.203 F 
ENDBRANCH  20  23
ENDBRANCH  19  20
ENDBRANCH  18  19
ENDBRANCH  17  18
ENDBRANCH   4  17
TORSDOF 8