REMARK  Name = BDB009318
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.638  -0.550   0.004  0.00  0.00    +0.072 A 
ATOM      2  C   LIG    1       -0.242  -1.833   0.369  0.00  0.00    +0.135 A 
ATOM      3  F   LIG    1        0.859  -2.033   1.108  0.00  0.00    -0.205 F 
ATOM      4  C   LIG    1       -0.980  -2.937  -0.042  0.00  0.00    +0.039 A 
ATOM      5  C   LIG    1       -2.135  -2.756  -0.807  0.00  0.00    +0.007 A 
ATOM      6  C   LIG    1       -2.573  -1.465  -1.151  0.00  0.00    -0.041 A 
ATOM      7  C   LIG    1       -1.805  -0.361  -0.748  0.00  0.00    +0.020 A 
ENDROOT
BRANCH   1  12
ATOM      8  N   LIG    1        4.221   1.283  -0.599  0.00  0.00    -0.298 NA
ATOM      9  C   LIG    1        3.583  -0.006  -0.914  0.00  0.00    +0.103 C 
ATOM     10  C   LIG    1        2.055   0.133  -1.053  0.00  0.00    +0.123 C 
ATOM     11  N   LIG    1        1.449   0.776   0.121  0.00  0.00    -0.295 N 
ATOM     12  C   LIG    1        0.108   0.631   0.470  0.00  0.00    +0.249 C 
ATOM     13  O   LIG    1       -0.511   1.444   1.153  0.00  0.00    -0.270 OA
ATOM     14  C   LIG    1        2.120   2.006   0.546  0.00  0.00    +0.123 C 
ATOM     15  C   LIG    1        3.649   1.837   0.642  0.00  0.00    +0.103 C 
BRANCH   8  16
ATOM     16  C   LIG    1        5.693   1.215  -0.575  0.00  0.00    +0.100 C 
BRANCH  16  17
ATOM     17  C   LIG    1        6.354   0.245   0.441  0.00  0.00    +0.099 C 
BRANCH  17  19
ATOM     18  C   LIG    1        8.444  -0.140  -0.759  0.00  0.00    +0.104 C 
ATOM     19  N   LIG    1        7.829   0.339   0.480  0.00  0.00    -0.307 NA
ATOM     20  C   LIG    1        8.347  -0.429   1.616  0.00  0.00    +0.104 C 
ENDBRANCH  17  19
ENDBRANCH  16  17
ENDBRANCH   8  16
ENDBRANCH   1  12
BRANCH   6  21
ATOM     21  C   LIG    1       -3.822  -1.303  -1.992  0.00  0.00    +0.092 C 
BRANCH  21  22
ATOM     22  C   LIG    1       -4.666  -0.079  -1.648  0.00  0.00    +0.069 A 
ATOM     23  C   LIG    1       -5.593  -0.126  -0.474  0.00  0.00    -0.016 A 
ATOM     24  C   LIG    1       -5.679  -1.349   0.395  0.00  0.00    +0.037 C 
ATOM     25  C   LIG    1       -6.428  -1.111   1.710  0.00  0.00    +0.005 C 
ATOM     26  C   LIG    1       -7.684  -0.278   1.487  0.00  0.00    +0.005 C 
ATOM     27  C   LIG    1       -7.339   1.077   0.866  0.00  0.00    +0.041 C 
ATOM     28  C   LIG    1       -6.332   0.973  -0.245  0.00  0.00    +0.023 A 
ATOM     29  C   LIG    1       -6.183   2.166  -1.117  0.00  0.00    +0.268 A 
ATOM     30  O   LIG    1       -6.836   3.188  -0.933  0.00  0.00    -0.266 OA
ATOM     31  N   LIG    1       -5.276   2.053  -2.136  0.00  0.00    -0.243 N 
ATOM     32  H   LIG    1       -5.157   2.859  -2.740  0.00  0.00    +0.192 HD
ATOM     33  N   LIG    1       -4.526   0.956  -2.422  0.00  0.00    -0.175 NA
ENDBRANCH  21  22
ENDBRANCH   6  21
TORSDOF 6