REMARK  Name = BDB026886
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.075   0.943  -1.377  0.00  0.00    +0.156 C 
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1        0.121   1.839  -0.144  0.00  0.00    -0.023 A 
ATOM      3  C   LIG    1        0.264   3.228  -0.313  0.00  0.00    +0.005 A 
ATOM      4  C   LIG    1        0.318   4.080   0.791  0.00  0.00    +0.000 A 
ATOM      5  C   LIG    1        0.236   3.558   2.079  0.00  0.00    +0.000 A 
ATOM      6  C   LIG    1        0.107   2.184   2.265  0.00  0.00    +0.000 A 
ATOM      7  C   LIG    1        0.055   1.329   1.163  0.00  0.00    +0.005 A 
ENDBRANCH   1   2
BRANCH   1   8
ATOM      8  C   LIG    1       -0.740  -0.373  -1.216  0.00  0.00    +0.186 C 
ATOM      9  O   LIG    1       -0.198  -1.472  -1.376  0.00  0.00    -0.290 OA
BRANCH   8  15
ATOM     10  C   LIG    1       -6.452  -3.924   0.273  0.00  0.00    +0.044 C 
ATOM     11  C   LIG    1       -5.278  -3.035  -0.020  0.00  0.00    -0.048 A 
ATOM     12  C   LIG    1       -5.457  -1.647  -0.118  0.00  0.00    +0.029 A 
ATOM     13  C   LIG    1       -4.342  -0.855  -0.424  0.00  0.00    +0.047 A 
ATOM     14  C   LIG    1       -3.071  -1.386  -0.645  0.00  0.00    +0.010 A 
ATOM     15  C   LIG    1       -2.182  -0.292  -0.925  0.00  0.00    +0.044 A 
ATOM     16  C   LIG    1       -2.954   0.857  -0.875  0.00  0.00    +0.095 A 
ATOM     17  C   LIG    1       -2.914  -2.785  -0.557  0.00  0.00    +0.011 A 
ATOM     18  N   LIG    1       -4.242   0.506  -0.569  0.00  0.00    -0.360 N 
ATOM     19  H   LIG    1       -5.013   1.151  -0.460  0.00  0.00    +0.165 HD
ATOM     20  C   LIG    1       -4.018  -3.593  -0.252  0.00  0.00    +0.004 A 
ENDBRANCH   8  15
ENDBRANCH   1   8
BRANCH   1  21
ATOM     21  N   LIG    1        1.423   0.689  -1.976  0.00  0.00    -0.303 NA
ATOM     22  H   LIG    1        1.265  -0.003  -2.715  0.00  0.00    +0.123 HD
BRANCH  21  23
ATOM     23  C   LIG    1        2.396   0.094  -1.045  0.00  0.00    +0.086 C 
BRANCH  23  24
ATOM     24  C   LIG    1        3.439   1.123  -0.590  0.00  0.00    +0.050 C 
BRANCH  24  25
ATOM     25  C   LIG    1        4.407   0.532   0.408  0.00  0.00    -0.046 A 
ATOM     26  C   LIG    1        4.163   0.656   1.785  0.00  0.00    +0.006 A 
ATOM     27  C   LIG    1        5.045   0.096   2.709  0.00  0.00    +0.038 A 
ATOM     28  C   LIG    1        6.166  -0.590   2.258  0.00  0.00    +0.123 A 
ATOM     29  F   LIG    1        7.012  -1.129   3.146  0.00  0.00    -0.205 F 
ATOM     30  C   LIG    1        6.423  -0.728   0.899  0.00  0.00    +0.038 A 
ATOM     31  C   LIG    1        5.542  -0.168  -0.028  0.00  0.00    +0.006 A 
ENDBRANCH  24  25
ENDBRANCH  23  24
ENDBRANCH  21  23
ENDBRANCH   1  21
TORSDOF 7