REMARK  Name = BDB008565
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        1.834  -0.924  -0.711  0.00  0.00    -0.331 N 
ATOM      2  C   LIG    1        1.399  -2.118  -1.221  0.00  0.00    +0.144 A 
ATOM      3  C   LIG    1        0.137  -2.363  -0.692  0.00  0.00    +0.059 A 
ATOM      4  C   LIG    1       -0.488  -3.549  -1.103  0.00  0.00    +0.136 A 
ATOM      5  C   LIG    1        0.163  -4.396  -1.989  0.00  0.00    +0.059 A 
ATOM      6  C   LIG    1        1.420  -4.026  -2.433  0.00  0.00    +0.116 A 
ATOM      7  F   LIG    1       -1.708  -3.873  -0.651  0.00  0.00    -0.205 F 
ATOM      8  C   LIG    1       -0.198  -1.270   0.176  0.00  0.00    +0.002 A 
ATOM      9  N   LIG    1        2.083  -2.902  -2.081  0.00  0.00    -0.237 NA
ATOM     10  C   LIG    1        0.886  -0.405   0.136  0.00  0.00    +0.093 A 
ENDROOT
BRANCH   8  11
ATOM     11  C   LIG    1       -1.491  -1.139   0.953  0.00  0.00    +0.106 C 
ATOM     12  C   LIG    1       -1.408  -1.918   2.271  0.00  0.00    +0.033 C 
BRANCH  11  13
ATOM     13  N   LIG    1       -1.876   0.290   1.087  0.00  0.00    -0.289 N 
ATOM     14  C   LIG    1       -2.242   1.068  -0.030  0.00  0.00    +0.246 C 
ATOM     15  O   LIG    1       -2.141   2.301  -0.019  0.00  0.00    -0.273 OA
BRANCH  14  16
ATOM     16  C   LIG    1       -2.837   0.343  -1.272  0.00  0.00    +0.217 C 
ATOM     17  O   LIG    1       -2.859   1.117  -2.474  0.00  0.00    -0.365 OA
ATOM     18  C   LIG    1       -3.848   2.154  -2.490  0.00  0.00    +0.176 C 
ATOM     19  C   LIG    1       -5.027   1.953  -1.524  0.00  0.00    +0.109 C 
ATOM     20  N   LIG    1       -5.400   0.544  -1.413  0.00  0.00    -0.311 NA
ATOM     21  H   LIG    1       -6.179   0.432  -0.766  0.00  0.00    +0.122 HD
ATOM     22  C   LIG    1       -4.242  -0.243  -0.951  0.00  0.00    +0.122 C 
ENDBRANCH  14  16
BRANCH  13  23
ATOM     23  C   LIG    1       -1.477   0.986   2.302  0.00  0.00    +0.077 C 
ATOM     24  C   LIG    1       -2.289   2.121   2.884  0.00  0.00    +0.024 C 
ATOM     25  C   LIG    1       -2.240   0.810   3.595  0.00  0.00    +0.024 C 
ENDBRANCH  13  23
ENDBRANCH  11  13
ENDBRANCH   8  11
BRANCH   1  26
ATOM     26  C   LIG    1        3.098  -0.285  -1.037  0.00  0.00    +0.123 C 
BRANCH  26  27
ATOM     27  C   LIG    1        4.217  -0.719  -0.093  0.00  0.00    +0.024 C 
BRANCH  27  28
ATOM     28  C   LIG    1        5.589  -0.160  -0.483  0.00  0.00    +0.030 C 
BRANCH  28  29
ATOM     29  C   LIG    1        5.656   1.362  -0.568  0.00  0.00    +0.159 C 
BRANCH  29  31
ATOM     30  C   LIG    1        5.194   3.346   0.615  0.00  0.00    +0.193 C 
ATOM     31  O   LIG    1        5.157   1.925   0.642  0.00  0.00    -0.383 OA
ENDBRANCH  29  31
ENDBRANCH  28  29
ENDBRANCH  27  28
ENDBRANCH  26  27
ENDBRANCH   1  26
TORSDOF 9