REMARK  Name = BDB017255
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1        0.237  -1.687  -2.635  0.00  0.00    -0.292 OA
ATOM      2  C   LIG    1        0.218  -1.343  -1.452  0.00  0.00    +0.167 C 
ENDROOT
BRANCH   2   3
ATOM      3  C   LIG    1        1.482  -0.826  -0.873  0.00  0.00    +0.018 A 
ATOM      4  C   LIG    1        2.651  -1.564  -1.091  0.00  0.00    +0.020 A 
ATOM      5  C   LIG    1        3.882  -1.122  -0.583  0.00  0.00    -0.017 A 
ATOM      6  C   LIG    1        3.936   0.090   0.142  0.00  0.00    -0.018 A 
ATOM      7  C   LIG    1        5.169   0.531   0.651  0.00  0.00    +0.014 A 
ATOM      8  C   LIG    1        6.343  -0.213   0.456  0.00  0.00    -0.022 A 
ATOM      9  C   LIG    1        6.279  -1.404  -0.273  0.00  0.00    +0.006 A 
ATOM     10  C   LIG    1        2.759   0.833   0.331  0.00  0.00    +0.009 A 
ATOM     11  C   LIG    1        5.061  -1.855  -0.785  0.00  0.00    +0.009 A 
ATOM     12  C   LIG    1        1.538   0.383  -0.179  0.00  0.00    +0.012 A 
BRANCH   8  13
ATOM     13  C   LIG    1        7.655   0.296   0.988  0.00  0.00    +0.191 C 
BRANCH  13  14
ATOM     14  O   LIG    1        8.158   1.336   0.160  0.00  0.00    -0.390 OA
ATOM     15  H   LIG    1        7.679   1.300  -0.686  0.00  0.00    +0.210 HD
ENDBRANCH  13  14
ENDBRANCH   8  13
ENDBRANCH   2   3
BRANCH   2  16
ATOM     16  C   LIG    1       -1.058  -1.446  -0.621  0.00  0.00    +0.074 C 
ATOM     17  C   LIG    1       -1.986  -0.264  -0.925  0.00  0.00    +0.096 C 
ATOM     18  N   LIG    1       -3.273  -0.383  -0.212  0.00  0.00    -0.299 NA
ATOM     19  C   LIG    1       -3.076  -0.491   1.238  0.00  0.00    +0.085 C 
ATOM     20  C   LIG    1       -2.211  -1.707   1.584  0.00  0.00    +0.016 C 
ATOM     21  C   LIG    1       -0.858  -1.639   0.883  0.00  0.00    +0.014 C 
BRANCH  18  22
ATOM     22  C   LIG    1       -4.215   0.659  -0.642  0.00  0.00    +0.057 C 
ATOM     23  C   LIG    1       -3.928   2.104  -0.222  0.00  0.00    +0.019 C 
ATOM     24  C   LIG    1       -5.226   2.846  -0.538  0.00  0.00    +0.002 C 
ATOM     25  C   LIG    1       -6.332   1.788  -0.557  0.00  0.00    +0.002 C 
ATOM     26  C   LIG    1       -5.661   0.474  -0.167  0.00  0.00    +0.019 C 
ENDBRANCH  18  22
ENDBRANCH   2  16
TORSDOF 5