REMARK  Name = BDB015089
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1        0.105  -3.179   1.417  0.00  0.00    -0.489 OA
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1        1.388  -2.728   1.556  0.00  0.00    +0.121 A 
ATOM      3  C   LIG    1        1.915  -1.548   1.027  0.00  0.00    +0.054 A 
ATOM      4  C   LIG    1        3.259  -1.189   1.246  0.00  0.00    -0.014 A 
ATOM      5  C   LIG    1        4.065  -2.045   2.011  0.00  0.00    +0.009 A 
ATOM      6  C   LIG    1        3.545  -3.223   2.545  0.00  0.00    +0.004 A 
ATOM      7  C   LIG    1        2.212  -3.559   2.317  0.00  0.00    +0.045 A 
BRANCH   4   8
ATOM      8  C   LIG    1        3.803   0.058   0.683  0.00  0.00    -0.016 A 
ATOM      9  C   LIG    1        4.883   0.015  -0.221  0.00  0.00    +0.036 A 
ATOM     10  C   LIG    1        5.357   1.228  -0.736  0.00  0.00    +0.069 A 
ATOM     11  C   LIG    1        4.809   2.460  -0.390  0.00  0.00    +0.089 A 
ATOM     12  N   LIG    1        5.455   3.486  -1.035  0.00  0.00    -0.236 NA
ATOM     13  C   LIG    1        6.381   2.906  -1.764  0.00  0.00    +0.200 A 
ATOM     14  C   LIG    1        3.739   2.505   0.512  0.00  0.00    +0.030 A 
ATOM     15  N   LIG    1        6.360   1.548  -1.618  0.00  0.00    -0.333 N 
ATOM     16  C   LIG    1        7.240   0.619  -2.277  0.00  0.00    +0.150 C 
ATOM     17  C   LIG    1        3.248   1.300   1.037  0.00  0.00    +0.011 A 
ENDBRANCH   4   8
ENDBRANCH   1   2
BRANCH   1  18
ATOM     18  C   LIG    1       -0.809  -2.429   0.602  0.00  0.00    +0.261 C 
BRANCH  18  19
ATOM     19  C   LIG    1       -1.483  -1.310   1.412  0.00  0.00    +0.166 C 
BRANCH  19  20
ATOM     20  O   LIG    1       -2.472  -1.866   2.291  0.00  0.00    -0.387 OA
ATOM     21  H   LIG    1       -2.797  -1.143   2.851  0.00  0.00    +0.210 HD
ENDBRANCH  19  20
BRANCH  19  22
ATOM     22  C   LIG    1       -2.083  -0.209   0.502  0.00  0.00    +0.119 C 
BRANCH  22  25
ATOM     23  C   LIG    1       -4.625  -2.496  -0.361  0.00  0.00    +0.024 C 
ATOM     24  C   LIG    1       -4.346  -1.022  -0.055  0.00  0.00    +0.058 C 
ATOM     25  N   LIG    1       -2.986  -0.685  -0.571  0.00  0.00    -0.293 NA
ATOM     26  C   LIG    1       -3.039   0.296  -1.675  0.00  0.00    +0.120 C 
ATOM     27  C   LIG    1       -3.869   1.508  -1.335  0.00  0.00    -0.030 A 
ATOM     28  C   LIG    1       -5.134   1.276  -0.773  0.00  0.00    -0.041 A 
ATOM     29  C   LIG    1       -5.975   2.348  -0.472  0.00  0.00    +0.004 A 
ATOM     30  C   LIG    1       -5.543   3.653  -0.713  0.00  0.00    +0.000 A 
ATOM     31  C   LIG    1       -4.282   3.886  -1.266  0.00  0.00    +0.000 A 
ATOM     32  C   LIG    1       -3.445   2.815  -1.583  0.00  0.00    +0.005 A 
ATOM     33  C   LIG    1       -5.533  -0.161  -0.579  0.00  0.00    +0.054 C 
ENDBRANCH  22  25
ENDBRANCH  19  22
ENDBRANCH  18  19
ENDBRANCH   1  18
TORSDOF 7