REMARK  Name = BDB009265
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.743   0.086  -1.192  0.00  0.00    +0.037 A 
ATOM      2  C   LIG    1       -1.580  -0.936  -0.723  0.00  0.00    +0.017 A 
ATOM      3  C   LIG    1       -2.741  -1.289  -1.425  0.00  0.00    -0.041 A 
ATOM      4  C   LIG    1       -3.041  -0.615  -2.618  0.00  0.00    +0.004 A 
ATOM      5  C   LIG    1       -2.216   0.410  -3.082  0.00  0.00    +0.001 A 
ATOM      6  C   LIG    1       -1.071   0.768  -2.368  0.00  0.00    +0.013 A 
ENDROOT
BRANCH   1   9
ATOM      7  N   LIG    1        1.539   0.931  -1.088  0.00  0.00    -0.311 N 
ATOM      8  H   LIG    1        1.541   0.872  -2.096  0.00  0.00    +0.149 HD
ATOM      9  C   LIG    1        0.461   0.431  -0.388  0.00  0.00    +0.244 C 
ATOM     10  O   LIG    1        0.463   0.237   0.822  0.00  0.00    -0.270 OA
BRANCH   7  11
ATOM     11  C   LIG    1        2.803   1.220  -0.431  0.00  0.00    +0.109 C 
BRANCH  11  12
ATOM     12  C   LIG    1        3.643  -0.042  -0.214  0.00  0.00    +0.057 C 
BRANCH  12  15
ATOM     13  C   LIG    1        7.408   0.562  -0.327  0.00  0.00    +0.121 A 
ATOM     14  C   LIG    1        6.097   0.255  -0.696  0.00  0.00    +0.053 A 
ATOM     15  C   LIG    1        5.049   0.284   0.241  0.00  0.00    -0.001 A 
ATOM     16  C   LIG    1        5.328   0.636   1.572  0.00  0.00    +0.124 A 
ATOM     17  C   LIG    1        6.641   0.943   1.939  0.00  0.00    +0.049 A 
ATOM     18  C   LIG    1        7.676   0.906   0.995  0.00  0.00    +0.049 A 
BRANCH  13  20
ATOM     19  C   LIG    1        9.674   0.775  -1.012  0.00  0.00    +0.277 C 
ATOM     20  O   LIG    1        8.320   0.493  -1.343  0.00  0.00    -0.495 OA
ENDBRANCH  13  20
BRANCH  16  21
ATOM     21  O   LIG    1        4.255   0.652   2.421  0.00  0.00    -0.495 OA
ATOM     22  C   LIG    1        4.493   0.985   3.782  0.00  0.00    +0.277 C 
ENDBRANCH  16  21
ENDBRANCH  12  15
ENDBRANCH  11  12
ENDBRANCH   7  11
ENDBRANCH   1   9
BRANCH   3  23
ATOM     23  C   LIG    1       -3.638  -2.393  -0.914  0.00  0.00    +0.092 C 
BRANCH  23  24
ATOM     24  C   LIG    1       -5.086  -1.953  -0.720  0.00  0.00    +0.069 A 
ATOM     25  C   LIG    1       -5.453  -1.097   0.453  0.00  0.00    -0.016 A 
ATOM     26  C   LIG    1       -4.426  -0.698   1.476  0.00  0.00    +0.037 C 
ATOM     27  C   LIG    1       -5.038  -0.132   2.761  0.00  0.00    +0.005 C 
ATOM     28  C   LIG    1       -6.160   0.849   2.446  0.00  0.00    +0.005 C 
ATOM     29  C   LIG    1       -7.267   0.173   1.635  0.00  0.00    +0.041 C 
ATOM     30  C   LIG    1       -6.739  -0.714   0.541  0.00  0.00    +0.023 A 
ATOM     31  C   LIG    1       -7.722  -1.163  -0.476  0.00  0.00    +0.268 A 
ATOM     32  O   LIG    1       -8.905  -0.846  -0.418  0.00  0.00    -0.266 OA
ATOM     33  N   LIG    1       -7.229  -1.957  -1.475  0.00  0.00    -0.243 N 
ATOM     34  H   LIG    1       -7.885  -2.276  -2.180  0.00  0.00    +0.192 HD
ATOM     35  N   LIG    1       -5.936  -2.352  -1.620  0.00  0.00    -0.175 NA
ENDBRANCH  23  24
ENDBRANCH   3  23
TORSDOF 8