REMARK  Name = BDB015039
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1        0.582  -1.065   0.677  0.00  0.00    -0.489 OA
ENDROOT
BRANCH   1   4
ATOM      2  C   LIG    1        4.207  -0.369   1.224  0.00  0.00    -0.011 A 
ATOM      3  C   LIG    1        2.942  -0.361   0.605  0.00  0.00    +0.054 A 
ATOM      4  C   LIG    1        1.849  -1.006   1.188  0.00  0.00    +0.121 A 
ATOM      5  C   LIG    1        2.015  -1.664   2.409  0.00  0.00    +0.045 A 
ATOM      6  C   LIG    1        3.257  -1.684   3.040  0.00  0.00    +0.004 A 
ATOM      7  C   LIG    1        4.346  -1.040   2.450  0.00  0.00    +0.009 A 
BRANCH   2   9
ATOM      8  C   LIG    1        5.872  -0.032  -0.658  0.00  0.00    +0.128 A 
ATOM      9  C   LIG    1        5.357   0.325   0.611  0.00  0.00    +0.024 A 
ATOM     10  C   LIG    1        5.965   1.387   1.308  0.00  0.00    +0.012 A 
ATOM     11  C   LIG    1        7.050   2.079   0.770  0.00  0.00    +0.001 A 
ATOM     12  C   LIG    1        7.546   1.721  -0.477  0.00  0.00    +0.004 A 
ATOM     13  C   LIG    1        6.961   0.671  -1.189  0.00  0.00    +0.046 A 
BRANCH   8  15
ATOM     14  C   LIG    1        5.768  -1.494  -2.549  0.00  0.00    +0.277 C 
ATOM     15  O   LIG    1        5.252  -1.081  -1.292  0.00  0.00    -0.495 OA
ENDBRANCH   8  15
ENDBRANCH   2   9
ENDBRANCH   1   4
BRANCH   1  16
ATOM     16  C   LIG    1        0.364  -0.445  -0.590  0.00  0.00    +0.261 C 
BRANCH  16  17
ATOM     17  C   LIG    1       -1.099  -0.633  -1.009  0.00  0.00    +0.166 C 
BRANCH  17  18
ATOM     18  O   LIG    1       -1.284  -0.072  -2.311  0.00  0.00    -0.387 OA
ATOM     19  H   LIG    1       -2.202  -0.303  -2.546  0.00  0.00    +0.210 HD
ENDBRANCH  17  18
BRANCH  17  20
ATOM     20  C   LIG    1       -2.066  -0.000   0.020  0.00  0.00    +0.119 C 
BRANCH  20  21
ATOM     21  N   LIG    1       -3.479  -0.032  -0.425  0.00  0.00    -0.295 NA
ATOM     22  C   LIG    1       -4.373  -0.262   0.724  0.00  0.00    +0.120 C 
ATOM     23  C   LIG    1       -5.831  -0.127   0.357  0.00  0.00    -0.030 A 
ATOM     24  C   LIG    1       -6.210   0.995  -0.397  0.00  0.00    -0.042 A 
ATOM     25  C   LIG    1       -7.553   1.215  -0.706  0.00  0.00    +0.004 A 
ATOM     26  C   LIG    1       -8.518   0.304  -0.278  0.00  0.00    +0.000 A 
ATOM     27  C   LIG    1       -8.146  -0.817   0.467  0.00  0.00    +0.000 A 
ATOM     28  C   LIG    1       -5.112   1.938  -0.802  0.00  0.00    +0.051 C 
ATOM     29  C   LIG    1       -6.805  -1.031   0.791  0.00  0.00    +0.005 A 
ATOM     30  C   LIG    1       -3.852   1.158  -1.228  0.00  0.00    +0.089 C 
ENDBRANCH  20  21
ENDBRANCH  17  20
ENDBRANCH  16  17
ENDBRANCH   1  16
TORSDOF 8