REMARK  Name = BDB051420
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1        1.566  -0.028   0.009  0.00  0.00    -0.477 OA
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1        0.251  -0.393   0.104  0.00  0.00    +0.122 A 
ATOM      3  C   LIG    1       -0.412  -0.773   1.270  0.00  0.00    +0.046 A 
ATOM      4  C   LIG    1       -1.760  -1.147   1.221  0.00  0.00    +0.007 A 
ATOM      5  C   LIG    1       -2.458  -1.155   0.006  0.00  0.00    -0.043 A 
ATOM      6  C   LIG    1       -1.780  -0.786  -1.162  0.00  0.00    +0.007 A 
ATOM      7  C   LIG    1       -0.435  -0.413  -1.111  0.00  0.00    +0.046 A 
BRANCH   5   8
ATOM      8  C   LIG    1       -3.915  -1.560  -0.043  0.00  0.00    +0.070 C 
BRANCH   8   9
ATOM      9  C   LIG    1       -4.856  -0.428  -0.389  0.00  0.00    -0.043 A 
ATOM     10  C   LIG    1       -5.531  -0.413  -1.618  0.00  0.00    +0.004 A 
ATOM     11  C   LIG    1       -6.399   0.633  -1.935  0.00  0.00    +0.000 A 
ATOM     12  C   LIG    1       -6.602   1.672  -1.030  0.00  0.00    +0.000 A 
ATOM     13  C   LIG    1       -5.937   1.668   0.194  0.00  0.00    +0.000 A 
ATOM     14  C   LIG    1       -5.068   0.624   0.514  0.00  0.00    +0.004 A 
ENDBRANCH   8   9
ENDBRANCH   5   8
ENDBRANCH   1   2
BRANCH   1  15
ATOM     15  C   LIG    1        2.238   0.393   1.202  0.00  0.00    +0.285 C 
BRANCH  15  17
ATOM     16  O   LIG    1        3.275  -0.708   3.107  0.00  0.00    -0.247 OA
ATOM     17  C   LIG    1        2.869  -0.777   1.955  0.00  0.00    +0.346 C 
BRANCH  17  18
ATOM     18  O   LIG    1        2.949  -1.914   1.222  0.00  0.00    -0.478 OA
ATOM     19  H   LIG    1        2.605  -1.759   0.314  0.00  0.00    +0.295 HD
ENDBRANCH  17  18
ENDBRANCH  15  17
BRANCH  15  20
ATOM     20  C   LIG    1        3.320   1.421   0.834  0.00  0.00    +0.091 C 
BRANCH  20  21
ATOM     21  C   LIG    1        4.386   0.898  -0.105  0.00  0.00    -0.043 A 
ATOM     22  C   LIG    1        5.575   0.355   0.400  0.00  0.00    +0.004 A 
ATOM     23  C   LIG    1        6.546  -0.149  -0.467  0.00  0.00    +0.000 A 
ATOM     24  C   LIG    1        6.338  -0.116  -1.844  0.00  0.00    +0.000 A 
ATOM     25  C   LIG    1        5.160   0.422  -2.357  0.00  0.00    +0.000 A 
ATOM     26  C   LIG    1        4.187   0.926  -1.493  0.00  0.00    +0.004 A 
ENDBRANCH  20  21
ENDBRANCH  15  20
ENDBRANCH   1  15
TORSDOF 8