REMARK  Name = BDB009293
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.261   1.152   3.091  0.00  0.00    +0.019 C 
ATOM      2  C   LIG    1        0.336   1.075   1.681  0.00  0.00    +0.067 C 
ENDROOT
BRANCH   2   3
ATOM      3  C   LIG    1        0.961  -0.308   1.391  0.00  0.00    +0.072 A 
ATOM      4  C   LIG    1        2.115  -0.404   0.436  0.00  0.00    -0.015 A 
ATOM      5  C   LIG    1        2.652   0.818  -0.257  0.00  0.00    +0.037 C 
ATOM      6  C   LIG    1        3.603   0.497  -1.415  0.00  0.00    +0.005 C 
ATOM      7  C   LIG    1        4.573  -0.615  -1.039  0.00  0.00    +0.005 C 
ATOM      8  C   LIG    1        3.820  -1.890  -0.656  0.00  0.00    +0.041 C 
ATOM      9  C   LIG    1        2.636  -1.627   0.234  0.00  0.00    +0.023 A 
ATOM     10  C   LIG    1        2.048  -2.809   0.911  0.00  0.00    +0.268 A 
ATOM     11  O   LIG    1        2.488  -3.941   0.740  0.00  0.00    -0.266 OA
ATOM     12  N   LIG    1        0.982  -2.559   1.730  0.00  0.00    -0.243 N 
ATOM     13  H   LIG    1        0.572  -3.354   2.209  0.00  0.00    +0.192 HD
ATOM     14  N   LIG    1        0.436  -1.342   1.984  0.00  0.00    -0.175 NA
ENDBRANCH   2   3
BRANCH   2  15
ATOM     15  C   LIG    1       -0.710   1.467   0.645  0.00  0.00    -0.037 A 
ATOM     16  C   LIG    1       -1.721   0.571   0.245  0.00  0.00    +0.030 A 
ATOM     17  C   LIG    1       -2.692   0.929  -0.706  0.00  0.00    +0.072 A 
ATOM     18  C   LIG    1       -2.638   2.218  -1.242  0.00  0.00    +0.145 A 
ATOM     19  F   LIG    1       -3.524   2.641  -2.151  0.00  0.00    -0.204 F 
ATOM     20  C   LIG    1       -1.655   3.125  -0.846  0.00  0.00    +0.040 A 
ATOM     21  C   LIG    1       -0.697   2.755   0.095  0.00  0.00    +0.007 A 
BRANCH  17  22
ATOM     22  N   LIG    1       -3.660  -0.010  -1.069  0.00  0.00    -0.268 N 
ATOM     23  C   LIG    1       -4.705  -0.007  -1.933  0.00  0.00    +0.221 C 
ATOM     24  O   LIG    1       -5.184   0.795  -2.698  0.00  0.00    -0.275 OA
ATOM     25  C   LIG    1       -5.052  -1.457  -1.559  0.00  0.00    +0.115 C 
ATOM     26  C   LIG    1       -3.846  -1.379  -0.608  0.00  0.00    +0.123 C 
ENDBRANCH  17  22
ENDBRANCH   2  15
TORSDOF 3