REMARK  Name = BDB064502
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.230  -0.711   1.480  0.00  0.00    +0.119 C 
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1       -1.511  -0.339   0.759  0.00  0.00    -0.033 A 
ATOM      3  C   LIG    1       -2.151  -1.263  -0.076  0.00  0.00    +0.012 A 
ATOM      4  C   LIG    1       -3.346  -0.940  -0.739  0.00  0.00    -0.008 A 
ATOM      5  C   LIG    1       -3.955  -1.949  -1.669  0.00  0.00    +0.047 C 
ATOM      6  C   LIG    1       -3.934   0.316  -0.511  0.00  0.00    +0.128 A 
ATOM      7  C   LIG    1       -3.273   1.281   0.267  0.00  0.00    -0.008 A 
ATOM      8  C   LIG    1       -3.813   2.670   0.451  0.00  0.00    +0.047 C 
ATOM      9  C   LIG    1       -2.083   0.929   0.922  0.00  0.00    +0.012 A 
BRANCH   6  10
ATOM     10  O   LIG    1       -5.110   0.649  -1.126  0.00  0.00    -0.475 OA
BRANCH  10  11
ATOM     11  C   LIG    1       -6.351   0.302  -0.461  0.00  0.00    +0.200 C 
ATOM     12  C   LIG    1       -7.147   1.614  -0.367  0.00  0.00    +0.067 C 
ATOM     13  C   LIG    1       -6.215  -0.320   0.942  0.00  0.00    +0.067 C 
BRANCH  11  14
ATOM     14  C   LIG    1       -7.154  -0.643  -1.393  0.00  0.00    +0.348 C 
ATOM     15  O   LIG    1       -6.800  -1.001  -2.508  0.00  0.00    -0.247 OA
BRANCH  14  16
ATOM     16  O   LIG    1       -8.351  -1.056  -0.900  0.00  0.00    -0.478 OA
ATOM     17  H   LIG    1       -8.602  -0.702  -0.029  0.00  0.00    +0.295 HD
ENDBRANCH  14  16
ENDBRANCH  11  14
ENDBRANCH  10  11
ENDBRANCH   6  10
ENDBRANCH   1   2
BRANCH   1  21
ATOM     18  N   LIG    1        3.656  -0.477   0.577  0.00  0.00    -0.313 N 
ATOM     19  C   LIG    1        3.358   0.343   1.762  0.00  0.00    +0.122 C 
ATOM     20  C   LIG    1        1.941   0.005   2.275  0.00  0.00    +0.103 C 
ATOM     21  N   LIG    1        0.852   0.271   1.305  0.00  0.00    -0.295 NA
ATOM     22  C   LIG    1        1.371   0.313  -0.080  0.00  0.00    +0.103 C 
ATOM     23  C   LIG    1        2.556  -0.632  -0.392  0.00  0.00    +0.122 C 
BRANCH  18  27
ATOM     24  C   LIG    1        7.605  -0.333  -0.778  0.00  0.00    +0.035 A 
ATOM     25  C   LIG    1        7.124   0.442   0.262  0.00  0.00    +0.124 A 
ATOM     26  N   LIG    1        5.843   0.404   0.709  0.00  0.00    -0.240 NA
ATOM     27  C   LIG    1        4.962  -0.427   0.107  0.00  0.00    +0.121 A 
ATOM     28  C   LIG    1        5.384  -1.252  -0.938  0.00  0.00    +0.044 A 
ATOM     29  C   LIG    1        6.707  -1.203  -1.387  0.00  0.00    +0.016 A 
BRANCH  24  31
ATOM     30  C   LIG    1        9.971   0.669  -0.567  0.00  0.00    +0.091 C 
ATOM     31  C   LIG    1        9.013  -0.274  -1.247  0.00  0.00    +0.162 C 
ATOM     32  O   LIG    1        9.375  -0.990  -2.178  0.00  0.00    -0.292 OA
ENDBRANCH  24  31
ENDBRANCH  18  27
ENDBRANCH   1  21
TORSDOF 8