REMARK  Name = BDB042486
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.981   1.247  -0.574  0.00  0.00    +0.021 C 
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1       -1.745   0.298  -1.508  0.00  0.00    +0.054 C 
BRANCH   2  10
ATOM      3  C   LIG    1       -5.106   0.983   2.660  0.00  0.00    +0.044 C 
ATOM      4  C   LIG    1       -5.725   0.071   1.637  0.00  0.00    -0.040 A 
ATOM      5  C   LIG    1       -5.066  -0.283   0.439  0.00  0.00    -0.008 A 
ATOM      6  C   LIG    1       -5.715  -1.143  -0.470  0.00  0.00    +0.049 A 
ATOM      7  C   LIG    1       -5.028  -1.519  -1.728  0.00  0.00    +0.257 A 
ATOM      8  N   LIG    1       -3.776  -0.986  -1.925  0.00  0.00    -0.326 N 
ATOM      9  H   LIG    1       -3.328  -1.260  -2.792  0.00  0.00    +0.169 HD
ATOM     10  C   LIG    1       -3.122  -0.145  -1.052  0.00  0.00    +0.020 A 
ATOM     11  O   LIG    1       -5.548  -2.265  -2.550  0.00  0.00    -0.267 OA
ATOM     12  C   LIG    1       -6.990  -1.650  -0.210  0.00  0.00    +0.052 A 
ATOM     13  C   LIG    1       -7.623  -1.294   0.968  0.00  0.00    +0.124 A 
ATOM     14  F   LIG    1       -8.846  -1.770   1.232  0.00  0.00    -0.205 F 
ATOM     15  C   LIG    1       -3.721   0.211   0.097  0.00  0.00    +0.030 A 
ATOM     16  C   LIG    1       -7.009  -0.446   1.885  0.00  0.00    +0.042 A 
ENDBRANCH   2  10
ENDBRANCH   1   2
BRANCH   1  17
ATOM     17  C   LIG    1        0.371   1.689  -1.157  0.00  0.00    +0.085 C 
BRANCH  17  18
ATOM     18  N   LIG    1        1.295   0.585  -1.451  0.00  0.00    -0.299 NA
ATOM     19  C   LIG    1        2.499   1.066  -2.174  0.00  0.00    +0.103 C 
ATOM     20  C   LIG    1        3.783   1.173  -1.321  0.00  0.00    +0.122 C 
ATOM     21  N   LIG    1        4.121  -0.137  -0.745  0.00  0.00    -0.313 N 
ATOM     22  C   LIG    1        2.982  -0.987  -0.363  0.00  0.00    +0.122 C 
ATOM     23  C   LIG    1        1.678  -0.162  -0.230  0.00  0.00    +0.103 C 
BRANCH  21  24
ATOM     24  C   LIG    1        5.304  -0.209  -0.026  0.00  0.00    +0.121 A 
ATOM     25  N   LIG    1        6.002   0.928   0.197  0.00  0.00    -0.239 NA
ATOM     26  C   LIG    1        7.170   0.858   0.882  0.00  0.00    +0.131 A 
ATOM     27  C   LIG    1        7.710  -0.318   1.368  0.00  0.00    +0.070 A 
ATOM     28  C   LIG    1        7.008  -1.491   1.129  0.00  0.00    +0.024 A 
ATOM     29  C   LIG    1        5.803  -1.434   0.424  0.00  0.00    +0.045 A 
BRANCH  27  30
ATOM     30  C   LIG    1        8.946  -0.315   2.082  0.00  0.00    +0.101 C 
ATOM     31  N   LIG    1        9.950  -0.312   2.664  0.00  0.00    -0.191 NA
ENDBRANCH  27  30
ENDBRANCH  21  24
ENDBRANCH  17  18
ENDBRANCH   1  17
TORSDOF 6