REMARK  Name = BDB065009
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.874   1.388  -0.546  0.00  0.00    +0.011 C 
ATOM      2  C   LIG    1        1.274   0.180  -0.501  0.00  0.00    -0.024 C 
ATOM      3  C   LIG    1       -0.223   0.052  -0.672  0.00  0.00    +0.207 C 
ATOM      4  O   LIG    1       -0.455  -0.697  -1.876  0.00  0.00    -0.456 OA
ATOM      5  C   LIG    1       -1.548  -1.460  -2.104  0.00  0.00    +0.319 C 
ATOM      6  C   LIG    1       -2.366  -1.888  -0.913  0.00  0.00    +0.171 C 
ATOM      7  C   LIG    1       -2.306  -0.953   0.300  0.00  0.00    +0.047 C 
ATOM      8  O   LIG    1       -1.766  -1.885  -3.235  0.00  0.00    -0.250 OA
ATOM      9  C   LIG    1       -0.848  -0.540   0.593  0.00  0.00    +0.048 C 
ATOM     10  C   LIG    1       -0.011  -1.669   1.250  0.00  0.00    +0.073 C 
ATOM     11  C   LIG    1        1.130  -2.232   0.396  0.00  0.00    +0.174 C 
ATOM     12  O   LIG    1        1.944  -3.069   1.240  0.00  0.00    -0.346 OA
ATOM     13  C   LIG    1        2.268  -4.191   0.422  0.00  0.00    +0.191 C 
ATOM     14  C   LIG    1        1.014  -4.380  -0.384  0.00  0.00    +0.191 C 
ATOM     15  O   LIG    1        0.567  -3.049  -0.646  0.00  0.00    -0.346 OA
ATOM     16  C   LIG    1        2.008  -1.121  -0.227  0.00  0.00    +0.099 C 
ENDROOT
BRANCH   1  20
ATOM     17  C   LIG    1        6.066   2.099  -0.087  0.00  0.00    +0.120 A 
ATOM     18  C   LIG    1        5.585   1.411  -1.204  0.00  0.00    +0.046 A 
ATOM     19  C   LIG    1        4.218   1.173  -1.362  0.00  0.00    +0.011 A 
ATOM     20  C   LIG    1        3.313   1.620  -0.396  0.00  0.00    -0.025 A 
ATOM     21  C   LIG    1        3.791   2.316   0.718  0.00  0.00    +0.011 A 
ATOM     22  C   LIG    1        5.162   2.552   0.874  0.00  0.00    +0.046 A 
BRANCH  17  24
ATOM     23  C   LIG    1        7.962   2.962   1.057  0.00  0.00    +0.277 C 
ATOM     24  O   LIG    1        7.423   2.261  -0.057  0.00  0.00    -0.495 OA
ENDBRANCH  17  24
ENDBRANCH   1  20
BRANCH   7  25
ATOM     25  C   LIG    1       -3.201   0.287   0.292  0.00  0.00    -0.042 A 
ATOM     26  C   LIG    1       -3.523   1.007  -0.866  0.00  0.00    +0.007 A 
ATOM     27  C   LIG    1       -4.329   2.152  -0.805  0.00  0.00    +0.046 A 
ATOM     28  C   LIG    1       -4.821   2.607   0.415  0.00  0.00    +0.120 A 
ATOM     29  C   LIG    1       -4.498   1.906   1.576  0.00  0.00    +0.046 A 
ATOM     30  C   LIG    1       -3.699   0.761   1.518  0.00  0.00    +0.007 A 
BRANCH  28  31
ATOM     31  O   LIG    1       -5.611   3.705   0.609  0.00  0.00    -0.495 OA
ATOM     32  C   LIG    1       -6.030   4.405  -0.556  0.00  0.00    +0.277 C 
ENDBRANCH  28  31
ENDBRANCH   7  25
BRANCH   6  33
ATOM     33  C   LIG    1       -3.799  -2.267  -1.262  0.00  0.00    +0.145 C 
ATOM     34  O   LIG    1       -4.481  -1.645  -2.076  0.00  0.00    -0.297 OA
ATOM     35  C   LIG    1       -4.386  -3.441  -0.519  0.00  0.00    +0.087 C 
ENDBRANCH   6  33
TORSDOF 5