REMARK  Name = BDB009284
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.779   2.034  -1.873  0.00  0.00    +0.037 A 
ATOM      2  C   LIG    1       -2.081   1.802  -1.415  0.00  0.00    +0.017 A 
ATOM      3  C   LIG    1       -3.174   2.001  -2.269  0.00  0.00    -0.041 A 
ATOM      4  C   LIG    1       -2.938   2.444  -3.580  0.00  0.00    +0.004 A 
ATOM      5  C   LIG    1       -1.640   2.710  -4.024  0.00  0.00    +0.001 A 
ATOM      6  C   LIG    1       -0.558   2.514  -3.168  0.00  0.00    +0.013 A 
ENDROOT
BRANCH   1   8
ATOM      7  N   LIG    1        1.427   1.028  -1.343  0.00  0.00    -0.300 N 
ATOM      8  C   LIG    1        0.351   1.819  -0.939  0.00  0.00    +0.246 C 
ATOM      9  O   LIG    1        0.288   2.359   0.164  0.00  0.00    -0.270 OA
ATOM     10  C   LIG    1        1.400   0.099  -2.467  0.00  0.00    +0.132 C 
BRANCH   7  11
ATOM     11  C   LIG    1        2.601   0.975  -0.471  0.00  0.00    +0.112 C 
BRANCH  11  12
ATOM     12  C   LIG    1        2.455  -0.059   0.650  0.00  0.00    +0.054 C 
BRANCH  12  16
ATOM     13  C   LIG    1        6.008  -0.169   3.113  0.00  0.00    +0.161 A 
ATOM     14  C   LIG    1        5.877  -1.059   2.028  0.00  0.00    +0.162 A 
ATOM     15  C   LIG    1        4.721  -1.023   1.238  0.00  0.00    +0.053 A 
ATOM     16  C   LIG    1        3.688  -0.116   1.519  0.00  0.00    -0.042 A 
ATOM     17  C   LIG    1        3.829   0.765   2.595  0.00  0.00    +0.007 A 
ATOM     18  C   LIG    1        4.979   0.738   3.388  0.00  0.00    +0.049 A 
BRANCH  13  20
ATOM     19  C   LIG    1        7.325   0.601   4.953  0.00  0.00    +0.277 C 
ATOM     20  O   LIG    1        7.173  -0.262   3.835  0.00  0.00    -0.491 OA
ENDBRANCH  13  20
BRANCH  14  21
ATOM     21  O   LIG    1        6.932  -1.914   1.821  0.00  0.00    -0.491 OA
ATOM     22  C   LIG    1        6.803  -2.889   0.796  0.00  0.00    +0.277 C 
ENDBRANCH  14  21
ENDBRANCH  12  16
ENDBRANCH  11  12
ENDBRANCH   7  11
ENDBRANCH   1   8
BRANCH   3  23
ATOM     23  C   LIG    1       -4.582   1.712  -1.800  0.00  0.00    +0.092 C 
BRANCH  23  24
ATOM     24  C   LIG    1       -4.926   0.227  -1.906  0.00  0.00    +0.069 A 
ATOM     25  C   LIG    1       -5.007  -0.610  -0.667  0.00  0.00    -0.016 A 
ATOM     26  C   LIG    1       -4.942   0.014   0.700  0.00  0.00    +0.037 C 
ATOM     27  C   LIG    1       -5.358  -0.937   1.826  0.00  0.00    +0.005 C 
ATOM     28  C   LIG    1       -4.760  -2.325   1.626  0.00  0.00    +0.005 C 
ATOM     29  C   LIG    1       -5.210  -2.923   0.291  0.00  0.00    +0.041 C 
ATOM     30  C   LIG    1       -5.165  -1.934  -0.842  0.00  0.00    +0.023 A 
ATOM     31  C   LIG    1       -5.329  -2.491  -2.209  0.00  0.00    +0.268 A 
ATOM     32  O   LIG    1       -5.471  -3.693  -2.406  0.00  0.00    -0.266 OA
ATOM     33  N   LIG    1       -5.340  -1.578  -3.228  0.00  0.00    -0.243 N 
ATOM     34  H   LIG    1       -5.451  -1.935  -4.170  0.00  0.00    +0.192 HD
ATOM     35  N   LIG    1       -5.106  -0.244  -3.106  0.00  0.00    -0.175 NA
ENDBRANCH  23  24
ENDBRANCH   3  23
TORSDOF 8