REMARK  Name = BDB009487
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.871   1.108   0.916  0.00  0.00    +0.072 A 
ATOM      2  C   LIG    1       -1.362   1.959   1.900  0.00  0.00    +0.135 A 
ATOM      3  F   LIG    1       -1.025   3.256   1.922  0.00  0.00    -0.205 F 
ATOM      4  C   LIG    1       -2.208   1.469   2.890  0.00  0.00    +0.039 A 
ATOM      5  C   LIG    1       -2.589   0.125   2.875  0.00  0.00    +0.007 A 
ATOM      6  C   LIG    1       -2.138  -0.739   1.860  0.00  0.00    -0.041 A 
ATOM      7  C   LIG    1       -1.258  -0.239   0.888  0.00  0.00    +0.020 A 
ENDROOT
BRANCH   1  14
ATOM      8  O   LIG    1        6.120   2.029   1.701  0.00  0.00    -0.270 OA
ATOM      9  C   LIG    1        5.562   1.749   0.645  0.00  0.00    +0.247 C 
ATOM     10  N   LIG    1        4.206   1.911   0.412  0.00  0.00    -0.295 N 
ATOM     11  C   LIG    1        3.564   1.729  -0.900  0.00  0.00    +0.127 C 
ATOM     12  C   LIG    1        2.174   2.376  -0.989  0.00  0.00    +0.127 C 
ATOM     13  N   LIG    1        1.305   1.959   0.115  0.00  0.00    -0.294 N 
ATOM     14  C   LIG    1       -0.016   1.622  -0.167  0.00  0.00    +0.249 C 
ATOM     15  O   LIG    1       -0.514   1.670  -1.289  0.00  0.00    -0.270 OA
ATOM     16  C   LIG    1        1.939   1.813   1.434  0.00  0.00    +0.127 C 
ATOM     17  C   LIG    1        3.354   2.403   1.497  0.00  0.00    +0.127 C 
BRANCH   9  18
ATOM     18  C   LIG    1        6.394   1.198  -0.440  0.00  0.00    +0.040 A 
ATOM     19  C   LIG    1        7.285   2.040  -1.098  0.00  0.00    +0.033 A 
ATOM     20  C   LIG    1        8.064   1.479  -2.088  0.00  0.00    +0.111 A 
ATOM     21  N   LIG    1        8.004   0.175  -2.440  0.00  0.00    -0.263 NA
ATOM     22  C   LIG    1        7.146  -0.615  -1.758  0.00  0.00    +0.111 A 
ATOM     23  C   LIG    1        6.324  -0.158  -0.751  0.00  0.00    +0.033 A 
ENDBRANCH   9  18
ENDBRANCH   1  14
BRANCH   6  24
ATOM     24  C   LIG    1       -2.576  -2.188   1.847  0.00  0.00    +0.092 C 
BRANCH  24  25
ATOM     25  C   LIG    1       -2.917  -2.720   0.457  0.00  0.00    +0.069 A 
ATOM     26  C   LIG    1       -4.149  -2.238  -0.242  0.00  0.00    -0.016 A 
ATOM     27  C   LIG    1       -5.106  -1.298   0.435  0.00  0.00    +0.037 C 
ATOM     28  C   LIG    1       -6.446  -1.162  -0.297  0.00  0.00    +0.005 C 
ATOM     29  C   LIG    1       -6.242  -1.036  -1.801  0.00  0.00    +0.005 C 
ATOM     30  C   LIG    1       -5.498  -2.250  -2.360  0.00  0.00    +0.041 C 
ATOM     31  C   LIG    1       -4.345  -2.682  -1.497  0.00  0.00    +0.023 A 
ATOM     32  C   LIG    1       -3.391  -3.647  -2.102  0.00  0.00    +0.268 A 
ATOM     33  O   LIG    1       -3.547  -4.089  -3.235  0.00  0.00    -0.266 OA
ATOM     34  N   LIG    1       -2.338  -4.023  -1.313  0.00  0.00    -0.243 N 
ATOM     35  H   LIG    1       -1.677  -4.675  -1.712  0.00  0.00    +0.192 HD
ATOM     36  N   LIG    1       -2.074  -3.566  -0.059  0.00  0.00    -0.175 NA
ENDBRANCH  24  25
ENDBRANCH   6  24
TORSDOF 4