REMARK  Name = BDB050372
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1        0.908   0.760   2.071  0.00  0.00    -0.491 OA
ENDROOT
BRANCH   1  10
ATOM      2  C   LIG    1        6.169  -0.220  -1.448  0.00  0.00    +0.144 A 
ATOM      3  C   LIG    1        5.567   1.057  -1.882  0.00  0.00    +0.351 A 
ATOM      4  O   LIG    1        6.085   1.793  -2.714  0.00  0.00    -0.244 OA
ATOM      5  O   LIG    1        4.368   1.420  -1.268  0.00  0.00    -0.421 OA
ATOM      6  C   LIG    1        3.808   0.664  -0.220  0.00  0.00    +0.143 A 
ATOM      7  C   LIG    1        4.426  -0.503   0.215  0.00  0.00    +0.019 A 
ATOM      8  C   LIG    1        3.847  -1.217   1.262  0.00  0.00    +0.015 A 
ATOM      9  C   LIG    1        2.667  -0.750   1.852  0.00  0.00    +0.046 A 
ATOM     10  C   LIG    1        2.053   0.425   1.403  0.00  0.00    +0.124 A 
ATOM     11  C   LIG    1        2.631   1.141   0.357  0.00  0.00    +0.092 A 
ATOM     12  C   LIG    1        5.641  -0.945  -0.448  0.00  0.00    +0.033 A 
BRANCH   2  13
ATOM     13  C   LIG    1        7.385  -0.768  -2.080  0.00  0.00    +0.346 C 
ATOM     14  O   LIG    1        8.235  -1.407  -1.474  0.00  0.00    -0.245 OA
BRANCH  13  16
ATOM     15  C   LIG    1        8.523  -1.034  -4.105  0.00  0.00    +0.280 C 
ATOM     16  O   LIG    1        7.378  -0.534  -3.414  0.00  0.00    -0.464 OA
ENDBRANCH  13  16
ENDBRANCH   2  13
ENDBRANCH   1  10
BRANCH   1  17
ATOM     17  C   LIG    1        0.200   1.920   1.616  0.00  0.00    +0.235 C 
BRANCH  17  18
ATOM     18  C   LIG    1       -1.067   2.083   2.454  0.00  0.00    +0.100 C 
BRANCH  18  19
ATOM     19  C   LIG    1       -2.127   1.114   2.067  0.00  0.00    +0.086 A 
ATOM     20  C   LIG    1       -2.304  -0.200   2.446  0.00  0.00    +0.126 A 
ATOM     21  C   LIG    1       -1.579  -1.140   3.317  0.00  0.00    +0.088 C 
ATOM     22  O   LIG    1       -3.421  -0.671   1.816  0.00  0.00    -0.440 OA
ATOM     23  C   LIG    1       -3.873   0.393   1.079  0.00  0.00    +0.228 A 
ATOM     24  N   LIG    1       -3.131   1.480   1.197  0.00  0.00    -0.214 NA
BRANCH  23  25
ATOM     25  C   LIG    1       -5.079   0.182   0.283  0.00  0.00    +0.037 A 
ATOM     26  C   LIG    1       -5.749  -1.050   0.261  0.00  0.00    +0.013 A 
ATOM     27  C   LIG    1       -6.903  -1.224  -0.511  0.00  0.00    +0.004 A 
ATOM     28  C   LIG    1       -7.417  -0.166  -1.268  0.00  0.00    -0.050 A 
ATOM     29  C   LIG    1       -8.635  -0.363  -2.121  0.00  0.00    +0.044 C 
ATOM     30  C   LIG    1       -6.746   1.061  -1.261  0.00  0.00    +0.004 A 
ATOM     31  C   LIG    1       -5.593   1.233  -0.490  0.00  0.00    +0.013 A 
ENDBRANCH  23  25
ENDBRANCH  18  19
ENDBRANCH  17  18
ENDBRANCH   1  17
TORSDOF 7