REMARK  Name = BDB063095
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        2.200  -1.199  -0.598  0.00  0.00    +0.004 C 
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1        1.198  -0.270  -1.295  0.00  0.00    +0.000 C 
BRANCH   2   3
ATOM      3  C   LIG    1        0.112   0.266  -0.358  0.00  0.00    +0.000 C 
BRANCH   3   4
ATOM      4  C   LIG    1       -0.897   1.182  -1.059  0.00  0.00    +0.000 C 
BRANCH   4   5
ATOM      5  C   LIG    1       -1.704   0.544  -2.194  0.00  0.00    +0.000 C 
BRANCH   5   6
ATOM      6  C   LIG    1       -2.480  -0.724  -1.827  0.00  0.00    -0.000 C 
BRANCH   6   7
ATOM      7  C   LIG    1       -3.512  -0.505  -0.718  0.00  0.00    -0.000 C 
BRANCH   7   8
ATOM      8  C   LIG    1       -4.338  -1.768  -0.475  0.00  0.00    -0.000 C 
BRANCH   8   9
ATOM      9  C   LIG    1       -5.279  -1.683   0.733  0.00  0.00    -0.000 C 
BRANCH   9  10
ATOM     10  C   LIG    1       -6.379  -0.623   0.614  0.00  0.00    -0.000 C 
BRANCH  10  12
ATOM     11  C   LIG    1       -7.142   1.710   1.185  0.00  0.00    +0.004 C 
ATOM     12  C   LIG    1       -6.028   0.685   1.328  0.00  0.00    -0.003 C 
ENDBRANCH  10  12
ENDBRANCH   9  10
ENDBRANCH   8   9
ENDBRANCH   7   8
ENDBRANCH   6   7
ENDBRANCH   5   6
ENDBRANCH   4   5
ENDBRANCH   3   4
ENDBRANCH   2   3
ENDBRANCH   1   2
BRANCH   1  13
ATOM     13  C   LIG    1        3.014  -0.578   0.543  0.00  0.00    +0.028 C 
BRANCH  13  14
ATOM     14  C   LIG    1        3.848   0.593   0.111  0.00  0.00    -0.014 C 
ATOM     15  C   LIG    1        5.188   0.618   0.021  0.00  0.00    +0.064 C 
ATOM     16  C   LIG    1        6.190  -0.432   0.315  0.00  0.00    +0.191 C 
ATOM     17  C   LIG    1        7.449   0.396   0.544  0.00  0.00    +0.207 C 
ATOM     18  C   LIG    1        7.684   0.736   2.011  0.00  0.00    +0.055 C 
ATOM     19  O   LIG    1        7.251   1.625  -0.177  0.00  0.00    -0.455 OA
ATOM     20  C   LIG    1        5.924   1.835  -0.391  0.00  0.00    +0.338 C 
ATOM     21  O   LIG    1        5.432   2.854  -0.839  0.00  0.00    -0.245 OA
BRANCH  16  22
ATOM     22  O   LIG    1        6.347  -1.266  -0.830  0.00  0.00    -0.383 OA
ATOM     23  H   LIG    1        5.460  -1.544  -1.118  0.00  0.00    +0.210 HD
ENDBRANCH  16  22
ENDBRANCH  13  14
ENDBRANCH   1  13
TORSDOF 13