REMARK  Name = BDB065205
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        2.149  -0.578   0.451  0.00  0.00    +0.122 A 
ATOM      2  C   LIG    1        1.693   0.546  -0.235  0.00  0.00    +0.046 A 
ATOM      3  C   LIG    1        0.355   0.943  -0.123  0.00  0.00    +0.012 A 
ATOM      4  C   LIG    1       -0.549   0.221   0.669  0.00  0.00    -0.017 A 
ATOM      5  C   LIG    1       -0.083  -0.911   1.349  0.00  0.00    +0.012 A 
ATOM      6  C   LIG    1        1.252  -1.306   1.236  0.00  0.00    +0.046 A 
ENDROOT
BRANCH   4   7
ATOM      7  C   LIG    1       -1.953   0.644   0.783  0.00  0.00    -0.010 A 
ATOM      8  C   LIG    1       -2.963   0.195  -0.116  0.00  0.00    -0.010 A 
ATOM      9  C   LIG    1       -4.293   0.654   0.061  0.00  0.00    -0.017 A 
ATOM     10  C   LIG    1       -5.307   0.226  -0.814  0.00  0.00    +0.008 A 
ATOM     11  C   LIG    1       -5.029  -0.651  -1.861  0.00  0.00    +0.001 A 
ATOM     12  C   LIG    1       -3.733  -1.111  -2.049  0.00  0.00    +0.001 A 
ATOM     13  C   LIG    1       -4.595   1.535   1.109  0.00  0.00    +0.008 A 
ATOM     14  C   LIG    1       -3.605   1.970   1.986  0.00  0.00    +0.001 A 
ATOM     15  C   LIG    1       -2.715  -0.695  -1.188  0.00  0.00    +0.009 A 
ATOM     16  C   LIG    1       -2.296   1.528   1.823  0.00  0.00    +0.009 A 
ENDBRANCH   4   7
BRANCH   1  17
ATOM     17  O   LIG    1        3.417  -1.084   0.427  0.00  0.00    -0.478 OA
BRANCH  17  19
ATOM     18  C   LIG    1        4.629  -0.646  -1.611  0.00  0.00    +0.064 C 
ATOM     19  C   LIG    1        4.468  -0.296  -0.136  0.00  0.00    +0.278 C 
BRANCH  19  20
ATOM     20  C   LIG    1        5.760  -0.629   0.606  0.00  0.00    +0.346 C 
ATOM     21  O   LIG    1        5.925  -1.436   1.507  0.00  0.00    -0.247 OA
BRANCH  20  22
ATOM     22  O   LIG    1        6.808   0.117   0.186  0.00  0.00    -0.478 OA
ATOM     23  H   LIG    1        7.547  -0.190   0.753  0.00  0.00    +0.295 HD
ENDBRANCH  20  22
ENDBRANCH  19  20
ENDBRANCH  17  19
ENDBRANCH   1  17
TORSDOF 5