REMARK  Name = BDB057786
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        0.945   0.234  -0.751  0.00  0.00    -0.302 NA
ATOM      2  C   LIG    1        0.650   1.133   0.375  0.00  0.00    +0.084 C 
ATOM      3  C   LIG    1       -0.746   0.946   0.979  0.00  0.00    +0.020 C 
ATOM      4  C   LIG    1       -1.843   1.084  -0.099  0.00  0.00    +0.003 C 
ATOM      5  C   LIG    1       -1.521   0.119  -1.255  0.00  0.00    +0.020 C 
ATOM      6  C   LIG    1       -0.099   0.348  -1.782  0.00  0.00    +0.084 C 
ENDROOT
BRANCH   1   7
ATOM      7  C   LIG    1        1.163  -1.166  -0.351  0.00  0.00    +0.087 C 
BRANCH   7   8
ATOM      8  C   LIG    1        2.431  -1.394   0.478  0.00  0.00    +0.056 C 
BRANCH   8   9
ATOM      9  C   LIG    1        3.693  -0.887  -0.213  0.00  0.00    +0.230 C 
BRANCH   9  10
ATOM     10  O   LIG    1        4.812  -1.259   0.597  0.00  0.00    -0.492 OA
BRANCH  10  14
ATOM     11  C   LIG    1        8.706  -0.281  -0.531  0.00  0.00    +0.052 A 
ATOM     12  C   LIG    1        8.431  -0.996   0.637  0.00  0.00    +0.022 A 
ATOM     13  C   LIG    1        7.109  -1.299   0.972  0.00  0.00    +0.047 A 
ATOM     14  C   LIG    1        6.052  -0.896   0.150  0.00  0.00    +0.121 A 
ATOM     15  C   LIG    1        6.329  -0.182  -1.016  0.00  0.00    +0.047 A 
ATOM     16  C   LIG    1        7.652   0.125  -1.356  0.00  0.00    +0.022 A 
BRANCH  11  18
ATOM     17  N   LIG    1       11.155   0.291  -1.169  0.00  0.00    -0.191 NA
ATOM     18  C   LIG    1       10.059   0.035  -0.883  0.00  0.00    +0.099 C 
ENDBRANCH  11  18
ENDBRANCH  10  14
ENDBRANCH   9  10
ENDBRANCH   8   9
ENDBRANCH   7   8
ENDBRANCH   1   7
BRANCH   4  19
ATOM     19  C   LIG    1       -3.280   0.950   0.511  0.00  0.00    +0.052 C 
BRANCH  19  20
ATOM     20  C   LIG    1       -4.416   1.667  -0.238  0.00  0.00    -0.040 A 
ATOM     21  C   LIG    1       -4.283   2.228  -1.516  0.00  0.00    +0.004 A 
ATOM     22  C   LIG    1       -5.358   2.875  -2.135  0.00  0.00    +0.000 A 
ATOM     23  C   LIG    1       -6.585   2.977  -1.486  0.00  0.00    +0.000 A 
ATOM     24  C   LIG    1       -6.740   2.436  -0.215  0.00  0.00    +0.000 A 
ATOM     25  C   LIG    1       -5.666   1.791   0.403  0.00  0.00    +0.004 A 
ENDBRANCH  19  20
BRANCH  19  26
ATOM     26  C   LIG    1       -3.641  -0.489   0.893  0.00  0.00    -0.040 A 
ATOM     27  C   LIG    1       -3.407  -0.949   2.200  0.00  0.00    +0.004 A 
ATOM     28  C   LIG    1       -3.726  -2.258   2.564  0.00  0.00    +0.000 A 
ATOM     29  C   LIG    1       -4.287  -3.126   1.630  0.00  0.00    +0.000 A 
ATOM     30  C   LIG    1       -4.532  -2.685   0.332  0.00  0.00    +0.000 A 
ATOM     31  C   LIG    1       -4.213  -1.376  -0.034  0.00  0.00    +0.004 A 
ENDBRANCH  19  26
ENDBRANCH   4  19
TORSDOF 9