REMARK  Name = BDB050367
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1        1.331   0.717  -2.791  0.00  0.00    -0.491 OA
ENDROOT
BRANCH   1  10
ATOM      2  C   LIG    1        6.027  -1.794   0.681  0.00  0.00    +0.211 C 
ATOM      3  C   LIG    1        4.813  -2.647   0.914  0.00  0.00    +0.327 C 
ATOM      4  O   LIG    1        4.820  -3.603   1.687  0.00  0.00    -0.249 OA
ATOM      5  O   LIG    1        3.658  -2.277   0.237  0.00  0.00    -0.425 OA
ATOM      6  C   LIG    1        3.689  -1.304  -0.780  0.00  0.00    +0.138 A 
ATOM      7  C   LIG    1        4.898  -0.877  -1.321  0.00  0.00    -0.003 A 
ATOM      8  C   LIG    1        4.875   0.051  -2.361  0.00  0.00    +0.011 A 
ATOM      9  C   LIG    1        3.651   0.552  -2.817  0.00  0.00    +0.046 A 
ATOM     10  C   LIG    1        2.442   0.129  -2.253  0.00  0.00    +0.124 A 
ATOM     11  C   LIG    1        2.463  -0.817  -1.232  0.00  0.00    +0.092 A 
ATOM     12  C   LIG    1        6.174  -1.456  -0.795  0.00  0.00    +0.065 C 
BRANCH   2  13
ATOM     13  C   LIG    1        6.004  -0.561   1.547  0.00  0.00    +0.321 C 
ATOM     14  O   LIG    1        5.048  -0.175   2.203  0.00  0.00    -0.250 OA
BRANCH  13  16
ATOM     15  C   LIG    1        7.290   1.250   2.297  0.00  0.00    +0.280 C 
ATOM     16  O   LIG    1        7.216   0.066   1.500  0.00  0.00    -0.467 OA
ENDBRANCH  13  16
ENDBRANCH   2  13
ENDBRANCH   1  10
BRANCH   1  17
ATOM     17  C   LIG    1        0.052   0.411  -2.226  0.00  0.00    +0.235 C 
BRANCH  17  18
ATOM     18  C   LIG    1       -0.222   1.265  -0.989  0.00  0.00    +0.100 C 
BRANCH  18  19
ATOM     19  C   LIG    1       -1.438   0.822  -0.265  0.00  0.00    +0.086 A 
ATOM     20  C   LIG    1       -1.549   0.186   0.954  0.00  0.00    +0.126 A 
ATOM     21  C   LIG    1       -0.593  -0.281   1.973  0.00  0.00    +0.088 C 
ATOM     22  O   LIG    1       -2.877  -0.026   1.195  0.00  0.00    -0.440 OA
ATOM     23  C   LIG    1       -3.512   0.500   0.099  0.00  0.00    +0.228 A 
ATOM     24  N   LIG    1       -2.691   1.012  -0.800  0.00  0.00    -0.214 NA
BRANCH  23  25
ATOM     25  C   LIG    1       -4.970   0.417   0.077  0.00  0.00    +0.037 A 
ATOM     26  C   LIG    1       -5.678   0.938  -1.014  0.00  0.00    +0.017 A 
ATOM     27  C   LIG    1       -7.074   0.870  -1.058  0.00  0.00    +0.046 A 
ATOM     28  C   LIG    1       -7.791   0.281  -0.016  0.00  0.00    +0.120 A 
ATOM     29  C   LIG    1       -7.098  -0.241   1.075  0.00  0.00    +0.046 A 
ATOM     30  C   LIG    1       -5.698  -0.172   1.120  0.00  0.00    +0.017 A 
BRANCH  28  31
ATOM     31  O   LIG    1       -9.148   0.279  -0.184  0.00  0.00    -0.495 OA
ATOM     32  C   LIG    1       -9.924  -0.309   0.852  0.00  0.00    +0.277 C 
ENDBRANCH  28  31
ENDBRANCH  23  25
ENDBRANCH  18  19
ENDBRANCH  17  18
ENDBRANCH   1  17
TORSDOF 8