REMARK  Name = BDB009223
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.387   1.598   0.369  0.00  0.00    +0.037 A 
ATOM      2  C   LIG    1       -2.485   1.445  -0.489  0.00  0.00    +0.017 A 
ATOM      3  C   LIG    1       -3.650   2.204  -0.299  0.00  0.00    -0.041 A 
ATOM      4  C   LIG    1       -3.685   3.135   0.750  0.00  0.00    +0.004 A 
ATOM      5  C   LIG    1       -2.598   3.279   1.615  0.00  0.00    +0.001 A 
ATOM      6  C   LIG    1       -1.451   2.507   1.432  0.00  0.00    +0.013 A 
ENDROOT
BRANCH   1   8
ATOM      7  O   LIG    1       -0.347  -0.406  -0.210  0.00  0.00    -0.270 OA
ATOM      8  C   LIG    1       -0.182   0.755   0.142  0.00  0.00    +0.248 C 
ATOM      9  N   LIG    1        1.021   1.411   0.332  0.00  0.00    -0.282 N 
ATOM     10  H   LIG    1        0.979   2.407   0.499  0.00  0.00    +0.155 HD
BRANCH   9  11
ATOM     11  C   LIG    1        2.317   0.865   0.229  0.00  0.00    +0.034 A 
ATOM     12  C   LIG    1        3.396   1.734   0.388  0.00  0.00    +0.025 A 
ATOM     13  C   LIG    1        4.715   1.264   0.306  0.00  0.00    +0.025 A 
ATOM     14  C   LIG    1        5.011  -0.086   0.064  0.00  0.00    +0.030 A 
ATOM     15  C   LIG    1        3.908  -0.939  -0.090  0.00  0.00    +0.025 A 
ATOM     16  C   LIG    1        2.583  -0.478  -0.008  0.00  0.00    +0.025 A 
BRANCH  14  17
ATOM     17  N   LIG    1        6.316  -0.548  -0.020  0.00  0.00    -0.330 N 
ATOM     18  C   LIG    1        7.419   0.188   0.606  0.00  0.00    +0.105 C 
ATOM     19  C   LIG    1        8.540  -0.767   1.011  0.00  0.00    +0.019 C 
ATOM     20  C   LIG    1        9.089  -1.552  -0.178  0.00  0.00    +0.003 C 
ATOM     21  C   LIG    1        8.048  -1.766  -1.274  0.00  0.00    +0.019 C 
ATOM     22  C   LIG    1        6.625  -1.799  -0.722  0.00  0.00    +0.105 C 
ENDBRANCH  14  17
ENDBRANCH   9  11
ENDBRANCH   1   8
BRANCH   3  23
ATOM     23  C   LIG    1       -4.833   2.070  -1.230  0.00  0.00    +0.092 C 
BRANCH  23  24
ATOM     24  C   LIG    1       -5.205   0.631  -1.575  0.00  0.00    +0.069 A 
ATOM     25  C   LIG    1       -5.805  -0.254  -0.527  0.00  0.00    -0.016 A 
ATOM     26  C   LIG    1       -6.087   0.262   0.856  0.00  0.00    +0.037 C 
ATOM     27  C   LIG    1       -7.006  -0.656   1.669  0.00  0.00    +0.005 C 
ATOM     28  C   LIG    1       -6.598  -2.115   1.513  0.00  0.00    +0.005 C 
ATOM     29  C   LIG    1       -6.652  -2.546   0.046  0.00  0.00    +0.041 C 
ATOM     30  C   LIG    1       -6.081  -1.519  -0.892  0.00  0.00    +0.023 A 
ATOM     31  C   LIG    1       -5.817  -1.968  -2.282  0.00  0.00    +0.268 A 
ATOM     32  O   LIG    1       -6.079  -3.107  -2.654  0.00  0.00    -0.266 OA
ATOM     33  N   LIG    1       -5.278  -1.032  -3.121  0.00  0.00    -0.243 N 
ATOM     34  H   LIG    1       -5.080  -1.321  -4.073  0.00  0.00    +0.192 HD
ATOM     35  N   LIG    1       -4.965   0.250  -2.795  0.00  0.00    -0.175 NA
ENDBRANCH  23  24
ENDBRANCH   3  23
TORSDOF 5