REMARK  Name = BDB009133
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.219   1.643  -1.249  0.00  0.00    +0.018 A 
ATOM      2  C   LIG    1        1.490   3.018  -1.286  0.00  0.00    +0.131 A 
ATOM      3  F   LIG    1        2.758   3.457  -1.284  0.00  0.00    -0.205 F 
ATOM      4  C   LIG    1        0.468   3.963  -1.335  0.00  0.00    +0.039 A 
ATOM      5  C   LIG    1       -0.862   3.548  -1.346  0.00  0.00    +0.006 A 
ATOM      6  C   LIG    1       -1.172   2.184  -1.312  0.00  0.00    -0.046 A 
ATOM      7  C   LIG    1       -0.130   1.243  -1.261  0.00  0.00    +0.015 A 
ENDROOT
BRANCH   1  10
ATOM      8  C   LIG    1        4.277  -0.287  -0.109  0.00  0.00    +0.037 A 
ATOM      9  C   LIG    1        3.248   0.663  -0.160  0.00  0.00    +0.021 A 
ATOM     10  C   LIG    1        2.298   0.644  -1.194  0.00  0.00    -0.014 A 
ATOM     11  C   LIG    1        2.402  -0.362  -2.170  0.00  0.00    +0.008 A 
ATOM     12  C   LIG    1        3.417  -1.320  -2.116  0.00  0.00    +0.001 A 
ATOM     13  C   LIG    1        4.354  -1.288  -1.084  0.00  0.00    +0.013 A 
BRANCH   8  15
ATOM     14  O   LIG    1        4.884   0.190   2.114  0.00  0.00    -0.270 OA
ATOM     15  C   LIG    1        5.247  -0.220   1.017  0.00  0.00    +0.244 C 
ATOM     16  N   LIG    1        6.540  -0.611   0.721  0.00  0.00    -0.308 N 
ATOM     17  H   LIG    1        6.798  -0.750  -0.247  0.00  0.00    +0.149 HD
BRANCH  16  18
ATOM     18  C   LIG    1        7.587  -0.548   1.691  0.00  0.00    +0.073 C 
ATOM     19  C   LIG    1        7.987  -1.778   2.457  0.00  0.00    +0.024 C 
ATOM     20  C   LIG    1        8.915  -1.204   1.428  0.00  0.00    +0.024 C 
ENDBRANCH  16  18
ENDBRANCH   8  15
ENDBRANCH   1  10
BRANCH   6  21
ATOM     21  C   LIG    1       -2.611   1.729  -1.290  0.00  0.00    +0.041 C 
BRANCH  21  22
ATOM     22  C   LIG    1       -3.187   1.761   0.124  0.00  0.00    +0.062 C 
BRANCH  22  23
ATOM     23  C   LIG    1       -4.596   1.192   0.116  0.00  0.00    +0.065 A 
ATOM     24  C   LIG    1       -4.810  -0.263   0.384  0.00  0.00    -0.016 A 
ATOM     25  C   LIG    1       -3.662  -1.159   0.762  0.00  0.00    +0.037 C 
ATOM     26  C   LIG    1       -4.099  -2.545   1.246  0.00  0.00    +0.005 C 
ATOM     27  C   LIG    1       -5.235  -3.099   0.396  0.00  0.00    +0.005 C 
ATOM     28  C   LIG    1       -6.446  -2.164   0.427  0.00  0.00    +0.041 C 
ATOM     29  C   LIG    1       -6.069  -0.719   0.259  0.00  0.00    +0.023 A 
ATOM     30  C   LIG    1       -7.172   0.220  -0.066  0.00  0.00    +0.268 A 
ATOM     31  O   LIG    1       -8.334  -0.158  -0.168  0.00  0.00    -0.266 OA
ATOM     32  N   LIG    1       -6.812   1.529  -0.239  0.00  0.00    -0.243 N 
ATOM     33  H   LIG    1       -7.550   2.187  -0.465  0.00  0.00    +0.192 HD
ATOM     34  N   LIG    1       -5.548   2.026  -0.176  0.00  0.00    -0.176 NA
ENDBRANCH  22  23
ENDBRANCH  21  22
ENDBRANCH   6  21
TORSDOF 6