REMARK  Name = BDB064736
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.849  -1.354  -0.004  0.00  0.00    -0.007 A 
ATOM      2  C   LIG    1        0.579  -1.718   0.506  0.00  0.00    -0.017 A 
ATOM      3  C   LIG    1        0.354  -3.035   0.944  0.00  0.00    +0.012 A 
ATOM      4  C   LIG    1        1.363  -3.995   0.874  0.00  0.00    +0.046 A 
ATOM      5  C   LIG    1        2.605  -3.637   0.369  0.00  0.00    +0.117 A 
ATOM      6  C   LIG    1        2.853  -2.338  -0.064  0.00  0.00    +0.054 A 
ENDROOT
BRANCH   1   9
ATOM      7  C   LIG    1        3.332   2.120  -0.242  0.00  0.00    +0.127 A 
ATOM      8  C   LIG    1        3.048   0.828   0.224  0.00  0.00    +0.041 A 
ATOM      9  C   LIG    1        2.155   0.006  -0.481  0.00  0.00    -0.015 A 
ATOM     10  C   LIG    1        1.566   0.506  -1.656  0.00  0.00    +0.008 A 
ATOM     11  C   LIG    1        1.850   1.794  -2.117  0.00  0.00    +0.003 A 
ATOM     12  C   LIG    1        2.734   2.608  -1.411  0.00  0.00    +0.033 A 
BRANCH   7  14
ATOM     13  O   LIG    1        4.457   4.123   0.085  0.00  0.00    -0.126 OA
ATOM     14  N   LIG    1        4.263   2.974   0.507  0.00  0.00    +0.056 N 
ATOM     15  O   LIG    1        4.796   2.498   1.518  0.00  0.00    -0.126 OA
ENDBRANCH   7  14
ENDBRANCH   1   9
BRANCH   2  16
ATOM     16  C   LIG    1       -0.504  -0.729   0.636  0.00  0.00    +0.009 C 
ATOM     17  C   LIG    1       -1.702  -0.888   0.051  0.00  0.00    +0.009 C 
BRANCH  17  18
ATOM     18  C   LIG    1       -2.787   0.100   0.137  0.00  0.00    -0.018 A 
ATOM     19  C   LIG    1       -2.541   1.480   0.067  0.00  0.00    +0.053 A 
ATOM     20  C   LIG    1       -3.605   2.379   0.119  0.00  0.00    +0.121 A 
ATOM     21  C   LIG    1       -4.914   1.929   0.230  0.00  0.00    +0.090 A 
ATOM     22  C   LIG    1       -5.158   0.563   0.284  0.00  0.00    +0.121 A 
ATOM     23  C   LIG    1       -4.110  -0.354   0.233  0.00  0.00    +0.053 A 
BRANCH  20  24
ATOM     24  O   LIG    1       -3.398   3.726   0.058  0.00  0.00    -0.507 OA
ATOM     25  H   LIG    1       -2.444   3.896   0.005  0.00  0.00    +0.292 HD
ENDBRANCH  20  24
BRANCH  22  26
ATOM     26  O   LIG    1       -6.455   0.153   0.387  0.00  0.00    -0.507 OA
ATOM     27  H   LIG    1       -6.477  -0.817   0.429  0.00  0.00    +0.292 HD
ENDBRANCH  22  26
ENDBRANCH  17  18
ENDBRANCH   2  16
BRANCH   5  28
ATOM     28  O   LIG    1        3.624  -4.539   0.280  0.00  0.00    -0.507 OA
ATOM     29  H   LIG    1        3.318  -5.394   0.626  0.00  0.00    +0.292 HD
ENDBRANCH   5  28
TORSDOF 7