REMARK  Name = BDB008916
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.750  -0.450   2.321  0.00  0.00    +0.092 C 
ENDROOT
BRANCH   1  10
ATOM      2  O   LIG    1       -2.980   3.803  -0.384  0.00  0.00    -0.266 OA
ATOM      3  C   LIG    1       -2.512   2.820   0.181  0.00  0.00    +0.268 A 
ATOM      4  C   LIG    1       -2.812   1.439  -0.272  0.00  0.00    +0.023 A 
ATOM      5  C   LIG    1       -3.696   1.310  -1.482  0.00  0.00    +0.041 C 
ATOM      6  C   LIG    1       -3.696  -0.100  -2.076  0.00  0.00    +0.005 C 
ATOM      7  C   LIG    1       -3.779  -1.154  -0.979  0.00  0.00    +0.005 C 
ATOM      8  C   LIG    1       -2.600  -1.033  -0.008  0.00  0.00    +0.037 C 
ATOM      9  C   LIG    1       -2.299   0.386   0.387  0.00  0.00    -0.016 A 
ATOM     10  C   LIG    1       -1.406   0.691   1.549  0.00  0.00    +0.069 A 
ATOM     11  N   LIG    1       -1.128   1.895   1.953  0.00  0.00    -0.175 NA
ATOM     12  N   LIG    1       -1.688   2.927   1.268  0.00  0.00    -0.243 N 
ATOM     13  H   LIG    1       -1.471   3.864   1.593  0.00  0.00    +0.192 HD
ENDBRANCH   1  10
BRANCH   1  14
ATOM     14  C   LIG    1        0.379  -1.123   1.574  0.00  0.00    -0.041 A 
ATOM     15  C   LIG    1        1.404  -0.363   0.979  0.00  0.00    +0.015 A 
ATOM     16  C   LIG    1        2.474  -0.968   0.290  0.00  0.00    +0.019 A 
ATOM     17  C   LIG    1        2.485  -2.369   0.229  0.00  0.00    +0.131 A 
ATOM     18  F   LIG    1        3.477  -3.012  -0.405  0.00  0.00    -0.205 F 
ATOM     19  C   LIG    1        1.490  -3.140   0.827  0.00  0.00    +0.039 A 
ATOM     20  C   LIG    1        0.442  -2.520   1.504  0.00  0.00    +0.007 A 
BRANCH  16  21
ATOM     21  C   LIG    1        3.529  -0.152  -0.337  0.00  0.00    +0.003 A 
ATOM     22  C   LIG    1        3.995  -0.405  -1.630  0.00  0.00    +0.119 A 
ATOM     23  N   LIG    1        4.950   0.316  -2.269  0.00  0.00    -0.263 NA
ATOM     24  C   LIG    1        5.485   1.348  -1.587  0.00  0.00    +0.111 A 
ATOM     25  C   LIG    1        5.109   1.692  -0.301  0.00  0.00    +0.020 A 
ATOM     26  C   LIG    1        4.122   0.932   0.325  0.00  0.00    +0.011 A 
ENDBRANCH  16  21
ENDBRANCH   1  14
TORSDOF 3