REMARK  Name = BDB009009
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.127  -1.158  -0.668  0.00  0.00    +0.034 A 
ATOM      2  C   LIG    1       -1.044  -1.604  -0.037  0.00  0.00    +0.027 A 
ATOM      3  C   LIG    1       -2.201  -1.909  -0.775  0.00  0.00    -0.040 A 
ATOM      4  C   LIG    1       -2.160  -1.797  -2.169  0.00  0.00    +0.004 A 
ATOM      5  C   LIG    1       -1.001  -1.353  -2.803  0.00  0.00    +0.002 A 
ATOM      6  C   LIG    1        0.135  -1.031  -2.057  0.00  0.00    +0.023 A 
ENDROOT
BRANCH   1   9
ATOM      7  O   LIG    1        2.826  -0.127  -1.379  0.00  0.00    -0.273 OA
ATOM      8  C   LIG    1        2.484  -0.399  -0.233  0.00  0.00    +0.243 C 
ATOM      9  N   LIG    1        1.235  -0.871   0.158  0.00  0.00    -0.284 N 
ATOM     10  H   LIG    1        1.098  -1.033   1.147  0.00  0.00    +0.155 HD
BRANCH   8  11
ATOM     11  C   LIG    1        3.426  -0.231   0.973  0.00  0.00    +0.256 C 
BRANCH  11  12
ATOM     12  O   LIG    1        4.748   0.132   0.612  0.00  0.00    -0.366 OA
BRANCH  12  13
ATOM     13  C   LIG    1        5.571   0.376   1.749  0.00  0.00    +0.195 C 
BRANCH  13  14
ATOM     14  C   LIG    1        6.979   0.734   1.339  0.00  0.00    -0.022 A 
ATOM     15  C   LIG    1        7.269   1.263   0.073  0.00  0.00    +0.006 A 
ATOM     16  C   LIG    1        8.575   1.618  -0.269  0.00  0.00    +0.000 A 
ATOM     17  C   LIG    1        9.607   1.459   0.654  0.00  0.00    +0.000 A 
ATOM     18  C   LIG    1        9.332   0.947   1.921  0.00  0.00    +0.000 A 
ATOM     19  C   LIG    1        8.026   0.591   2.263  0.00  0.00    +0.006 A 
ENDBRANCH  13  14
ENDBRANCH  12  13
ENDBRANCH  11  12
ENDBRANCH   8  11
ENDBRANCH   1   9
BRANCH   3  20
ATOM     20  C   LIG    1       -3.445  -2.400  -0.071  0.00  0.00    +0.092 C 
BRANCH  20  21
ATOM     21  C   LIG    1       -4.730  -1.720  -0.536  0.00  0.00    +0.069 A 
ATOM     22  C   LIG    1       -4.989  -0.290  -0.172  0.00  0.00    -0.016 A 
ATOM     23  C   LIG    1       -4.020   0.481   0.680  0.00  0.00    +0.037 C 
ATOM     24  C   LIG    1       -4.606   1.784   1.233  0.00  0.00    +0.005 C 
ATOM     25  C   LIG    1       -5.375   2.538   0.156  0.00  0.00    +0.005 C 
ATOM     26  C   LIG    1       -6.519   1.687  -0.398  0.00  0.00    +0.041 C 
ATOM     27  C   LIG    1       -6.124   0.256  -0.641  0.00  0.00    +0.023 A 
ATOM     28  C   LIG    1       -7.065  -0.559  -1.451  0.00  0.00    +0.268 A 
ATOM     29  O   LIG    1       -8.117  -0.098  -1.879  0.00  0.00    -0.266 OA
ATOM     30  N   LIG    1       -6.688  -1.854  -1.681  0.00  0.00    -0.243 N 
ATOM     31  H   LIG    1       -7.316  -2.428  -2.235  0.00  0.00    +0.192 HD
ATOM     32  N   LIG    1       -5.543  -2.444  -1.247  0.00  0.00    -0.175 NA
ENDBRANCH  20  21
ENDBRANCH   3  20
TORSDOF 7