REMARK  Name = BDB009066
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.437  -0.953  -1.080  0.00  0.00    +0.034 A 
ATOM      2  C   LIG    1        0.485  -1.261  -0.098  0.00  0.00    +0.027 A 
ATOM      3  C   LIG    1       -0.624  -2.074  -0.387  0.00  0.00    -0.040 A 
ATOM      4  C   LIG    1       -0.751  -2.610  -1.673  0.00  0.00    +0.004 A 
ATOM      5  C   LIG    1        0.195  -2.314  -2.652  0.00  0.00    +0.002 A 
ATOM      6  C   LIG    1        1.283  -1.487  -2.358  0.00  0.00    +0.023 A 
ENDROOT
BRANCH   1   8
ATOM      7  C   LIG    1        3.513   0.392  -1.493  0.00  0.00    +0.265 C 
ATOM      8  N   LIG    1        2.511  -0.126  -0.694  0.00  0.00    -0.280 N 
ATOM      9  H   LIG    1        2.500   0.202   0.262  0.00  0.00    +0.155 HD
ATOM     10  O   LIG    1        3.576   0.293  -2.712  0.00  0.00    -0.268 OA
BRANCH   7  13
ATOM     11  C   LIG    1        5.106  -0.587   0.995  0.00  0.00    +0.149 C 
ATOM     12  N   LIG    1        5.169   0.732   0.398  0.00  0.00    -0.346 N 
ATOM     13  C   LIG    1        4.497   1.147  -0.735  0.00  0.00    +0.104 A 
ATOM     14  C   LIG    1        4.991   2.406  -1.044  0.00  0.00    +0.032 A 
ATOM     15  C   LIG    1        5.908   2.783  -0.037  0.00  0.00    +0.020 A 
ATOM     16  C   LIG    1        5.992   1.733   0.847  0.00  0.00    +0.086 A 
ENDBRANCH   7  13
ENDBRANCH   1   8
BRANCH   3  17
ATOM     17  C   LIG    1       -1.642  -2.404   0.680  0.00  0.00    +0.092 C 
BRANCH  17  18
ATOM     18  C   LIG    1       -2.164  -1.179   1.425  0.00  0.00    +0.069 A 
ATOM     19  C   LIG    1       -3.124  -0.250   0.749  0.00  0.00    -0.016 A 
ATOM     20  C   LIG    1       -3.619  -0.526  -0.644  0.00  0.00    +0.037 C 
ATOM     21  C   LIG    1       -4.831   0.325  -1.035  0.00  0.00    +0.005 C 
ATOM     22  C   LIG    1       -4.644   1.775  -0.609  0.00  0.00    +0.005 C 
ATOM     23  C   LIG    1       -4.443   1.879   0.904  0.00  0.00    +0.041 C 
ATOM     24  C   LIG    1       -3.514   0.829   1.449  0.00  0.00    +0.023 A 
ATOM     25  C   LIG    1       -3.021   1.038   2.833  0.00  0.00    +0.268 A 
ATOM     26  O   LIG    1       -3.372   2.000   3.508  0.00  0.00    -0.266 OA
ATOM     27  N   LIG    1       -2.155   0.091   3.309  0.00  0.00    -0.243 N 
ATOM     28  H   LIG    1       -1.812   0.214   4.256  0.00  0.00    +0.192 HD
ATOM     29  N   LIG    1       -1.715  -1.003   2.634  0.00  0.00    -0.175 NA
ENDBRANCH  17  18
ENDBRANCH   3  17
TORSDOF 4