REMARK  Name = BDB015123
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1       -1.322   1.214  -1.069  0.00  0.00    -0.489 OA
ENDROOT
BRANCH   1   4
ATOM      2  C   LIG    1       -4.310  -0.684  -0.267  0.00  0.00    +0.037 A 
ATOM      3  C   LIG    1       -3.303   0.283  -0.279  0.00  0.00    +0.069 A 
ATOM      4  C   LIG    1       -2.232   0.202  -1.181  0.00  0.00    +0.122 A 
ATOM      5  C   LIG    1       -2.162  -0.870  -2.065  0.00  0.00    +0.046 A 
ATOM      6  C   LIG    1       -3.161  -1.844  -2.062  0.00  0.00    +0.005 A 
ATOM      7  C   LIG    1       -4.230  -1.750  -1.170  0.00  0.00    +0.023 A 
BRANCH   2  10
ATOM      8  O   LIG    1       -5.080   1.270   1.842  0.00  0.00    -0.266 OA
ATOM      9  C   LIG    1       -5.733   0.268   1.575  0.00  0.00    +0.285 C 
ATOM     10  N   LIG    1       -5.417  -0.666   0.604  0.00  0.00    -0.279 N 
ATOM     11  H   LIG    1       -6.076  -1.432   0.516  0.00  0.00    +0.155 HD
BRANCH   9  12
ATOM     12  C   LIG    1       -6.954  -0.051   2.277  0.00  0.00    +0.209 A 
ATOM     13  O   LIG    1       -7.676  -1.181   1.960  0.00  0.00    -0.438 OA
ATOM     14  C   LIG    1       -8.735  -1.140   2.816  0.00  0.00    +0.308 A 
ATOM     15  N   LIG    1       -8.757  -0.112   3.632  0.00  0.00    -0.224 NA
ATOM     16  C   LIG    1       -7.625   0.588   3.296  0.00  0.00    +0.165 A 
ENDBRANCH   9  12
ENDBRANCH   2  10
ENDBRANCH   1   4
BRANCH   1  17
ATOM     17  C   LIG    1       -0.375   1.425  -2.119  0.00  0.00    +0.261 C 
BRANCH  17  18
ATOM     18  C   LIG    1        1.020   0.851  -1.795  0.00  0.00    +0.166 C 
BRANCH  18  19
ATOM     19  O   LIG    1        1.035  -0.554  -2.061  0.00  0.00    -0.387 OA
ATOM     20  H   LIG    1        1.944  -0.856  -1.905  0.00  0.00    +0.210 HD
ENDBRANCH  18  19
BRANCH  18  21
ATOM     21  C   LIG    1        1.441   1.156  -0.336  0.00  0.00    +0.119 C 
BRANCH  21  22
ATOM     22  N   LIG    1        2.790   0.772   0.115  0.00  0.00    -0.295 NA
ATOM     23  C   LIG    1        3.878   1.138  -0.794  0.00  0.00    +0.120 C 
ATOM     24  C   LIG    1        5.251   0.771  -0.268  0.00  0.00    -0.030 A 
ATOM     25  C   LIG    1        5.404  -0.168   0.768  0.00  0.00    -0.042 A 
ATOM     26  C   LIG    1        6.687  -0.511   1.214  0.00  0.00    +0.004 A 
ATOM     27  C   LIG    1        7.814   0.054   0.618  0.00  0.00    +0.000 A 
ATOM     28  C   LIG    1        7.668   0.970  -0.421  0.00  0.00    +0.000 A 
ATOM     29  C   LIG    1        4.187  -0.750   1.444  0.00  0.00    +0.051 C 
ATOM     30  C   LIG    1        6.394   1.326  -0.864  0.00  0.00    +0.005 A 
ATOM     31  C   LIG    1        2.914  -0.603   0.597  0.00  0.00    +0.089 C 
ENDBRANCH  21  22
ENDBRANCH  18  21
ENDBRANCH  17  18
ENDBRANCH   1  17
TORSDOF 8