REMARK  Name = BDB018566
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -2.059  -1.237  -0.754  0.00  0.00    -0.002 A 
ATOM      2  C   LIG    1       -0.675  -1.325  -1.243  0.00  0.00    +0.009 A 
ATOM      3  C   LIG    1       -0.347  -2.368  -2.031  0.00  0.00    +0.098 A 
ATOM      4  N   LIG    1       -1.260  -3.339  -2.402  0.00  0.00    -0.318 N 
ATOM      5  C   LIG    1       -0.815  -4.413  -3.277  0.00  0.00    +0.152 C 
ATOM      6  C   LIG    1       -2.589  -3.300  -2.000  0.00  0.00    +0.252 A 
ATOM      7  O   LIG    1       -3.449  -4.117  -2.315  0.00  0.00    -0.268 OA
ATOM      8  C   LIG    1       -2.960  -2.169  -1.113  0.00  0.00    +0.079 A 
ENDROOT
BRANCH   1  13
ATOM      9  C   LIG    1       -3.796   2.776   2.950  0.00  0.00    +0.065 C 
ATOM     10  C   LIG    1       -3.368   1.736   1.959  0.00  0.00    +0.038 A 
ATOM     11  N   LIG    1       -2.595   0.723   2.416  0.00  0.00    -0.260 NA
ATOM     12  C   LIG    1       -2.200  -0.209   1.516  0.00  0.00    +0.119 A 
ATOM     13  C   LIG    1       -2.543  -0.192   0.167  0.00  0.00    +0.001 A 
ATOM     14  C   LIG    1       -3.346   0.859  -0.276  0.00  0.00    +0.012 A 
ATOM     15  C   LIG    1       -3.763   1.836   0.627  0.00  0.00    +0.023 A 
ENDBRANCH   1  13
BRANCH   2  16
ATOM     16  C   LIG    1        0.299  -0.332  -0.908  0.00  0.00    +0.022 A 
ATOM     17  C   LIG    1        1.487  -0.540  -0.244  0.00  0.00    +0.123 A 
ATOM     18  N   LIG    1        2.108   0.691  -0.119  0.00  0.00    -0.238 N 
ATOM     19  N   LIG    1        1.376   1.655  -0.717  0.00  0.00    -0.174 NA
ATOM     20  C   LIG    1        0.283   1.045  -1.170  0.00  0.00    +0.143 A 
BRANCH  18  21
ATOM     21  C   LIG    1        3.344   0.993   0.533  0.00  0.00    +0.085 A 
ATOM     22  C   LIG    1        3.908   2.288   0.518  0.00  0.00    +0.112 A 
ATOM     23  C   LIG    1        5.119   2.502   1.193  0.00  0.00    +0.143 A 
ATOM     24  F   LIG    1        5.686   3.718   1.197  0.00  0.00    -0.204 F 
ATOM     25  C   LIG    1        5.776   1.480   1.870  0.00  0.00    +0.040 A 
ATOM     26  C   LIG    1        5.226   0.206   1.885  0.00  0.00    +0.005 A 
ATOM     27  C   LIG    1        4.019  -0.038   1.222  0.00  0.00    +0.029 A 
BRANCH  22  28
ATOM     28  C   LIG    1        3.358   3.434  -0.153  0.00  0.00    +0.104 C 
ATOM     29  N   LIG    1        2.985   4.400  -0.680  0.00  0.00    -0.191 NA
ENDBRANCH  22  28
ENDBRANCH  18  21
ENDBRANCH   2  16
TORSDOF 4