REMARK  Name = BDB042603
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.813  -0.787   1.201  0.00  0.00    +0.102 C 
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1        0.549  -1.595   1.442  0.00  0.00    +0.216 C 
ATOM      3  N   LIG    1       -0.635  -0.878   1.542  0.00  0.00    -0.298 N 
ATOM      4  C   LIG    1       -0.723   0.586   1.464  0.00  0.00    +0.126 C 
ATOM      5  C   LIG    1       -2.105   1.134   1.846  0.00  0.00    +0.126 C 
ATOM      6  N   LIG    1       -3.183   0.465   1.112  0.00  0.00    -0.298 N 
ATOM      7  C   LIG    1       -4.308   1.204   0.765  0.00  0.00    +0.219 C 
ATOM      8  O   LIG    1       -4.425   2.381   1.110  0.00  0.00    -0.275 OA
ATOM      9  C   LIG    1       -3.054  -0.992   0.953  0.00  0.00    +0.126 C 
ATOM     10  C   LIG    1       -1.892  -1.597   1.756  0.00  0.00    +0.126 C 
ATOM     11  O   LIG    1        0.580  -2.821   1.542  0.00  0.00    -0.276 OA
BRANCH   7  12
ATOM     12  C   LIG    1       -5.361   0.531  -0.126  0.00  0.00    +0.075 C 
ATOM     13  C   LIG    1       -4.884   0.515  -1.582  0.00  0.00    +0.013 C 
ATOM     14  C   LIG    1       -5.834  -0.280  -2.480  0.00  0.00    +0.001 C 
ATOM     15  C   LIG    1       -7.290  -0.238  -2.014  0.00  0.00    +0.000 C 
ATOM     16  C   LIG    1       -7.607   1.052  -1.271  0.00  0.00    +0.001 C 
ATOM     17  C   LIG    1       -6.734   1.229  -0.024  0.00  0.00    +0.013 C 
ENDBRANCH   7  12
ENDBRANCH   1   2
BRANCH   1  18
ATOM     18  C   LIG    1        3.032  -1.693   1.008  0.00  0.00    +0.062 C 
BRANCH  18  26
ATOM     19  C   LIG    1        6.162  -0.701  -3.186  0.00  0.00    +0.044 C 
ATOM     20  C   LIG    1        6.701   0.019  -1.978  0.00  0.00    -0.042 A 
ATOM     21  C   LIG    1        6.077  -0.059  -0.712  0.00  0.00    -0.005 A 
ATOM     22  C   LIG    1        6.638   0.639   0.379  0.00  0.00    +0.082 A 
ATOM     23  C   LIG    1        5.982   0.553   1.707  0.00  0.00    +0.259 A 
ATOM     24  N   LIG    1        4.843  -0.218   1.777  0.00  0.00    -0.326 N 
ATOM     25  H   LIG    1        4.430  -0.275   2.702  0.00  0.00    +0.169 HD
ATOM     26  C   LIG    1        4.281  -0.896   0.724  0.00  0.00    +0.020 A 
ATOM     27  O   LIG    1        6.404   1.125   2.705  0.00  0.00    -0.267 OA
ATOM     28  C   LIG    1        7.794   1.398   0.208  0.00  0.00    +0.136 A 
ATOM     29  F   LIG    1        8.350   2.074   1.222  0.00  0.00    -0.205 F 
ATOM     30  C   LIG    1        8.408   1.476  -1.036  0.00  0.00    +0.039 A 
ATOM     31  C   LIG    1        4.854  -0.847  -0.488  0.00  0.00    +0.030 A 
ATOM     32  C   LIG    1        7.867   0.791  -2.123  0.00  0.00    +0.007 A 
ENDBRANCH  18  26
ENDBRANCH   1  18
TORSDOF 4