REMARK  Name = BDB028423
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.953   1.284  -0.876  0.00  0.00    +0.000 A 
ATOM      2  C   LIG    1       -0.684   0.967  -0.368  0.00  0.00    +0.000 A 
ATOM      3  C   LIG    1        0.421   0.820  -1.232  0.00  0.00    +0.000 A 
ATOM      4  C   LIG    1        0.238   1.002  -2.623  0.00  0.00    +0.000 A 
ATOM      5  C   LIG    1        1.341   0.856  -3.480  0.00  0.00    +0.000 A 
ATOM      6  N   LIG    1        2.557   0.543  -2.960  0.00  0.00    +0.000 N 
ATOM      7  H   LIG    1        3.379   0.433  -3.595  0.00  0.00    +0.000 HD
ATOM      8  N   LIG    1        2.730   0.369  -1.651  0.00  0.00    +0.000 NA
ATOM      9  O   LIG    1        1.220   1.011  -4.726  0.00  0.00    +0.000 OA
ATOM     10  C   LIG    1       -1.037   1.325  -3.122  0.00  0.00    +0.000 A 
ATOM     11  C   LIG    1        1.712   0.493  -0.755  0.00  0.00    +0.000 A 
ATOM     12  C   LIG    1       -2.121   1.464  -2.255  0.00  0.00    +0.000 A 
ENDROOT
BRANCH   1  19
ATOM     13  C   LIG    1       -4.985   0.359   2.728  0.00  0.00    +0.000 C 
ATOM     14  C   LIG    1       -4.140  -0.034   1.494  0.00  0.00    +0.000 C 
ATOM     15  C   LIG    1       -4.938   0.083   0.113  0.00  0.00    +0.000 C 
ATOM     16  C   LIG    1       -4.634  -1.058  -0.900  0.00  0.00    +0.000 C 
ATOM     17  C   LIG    1       -6.474   0.137   0.274  0.00  0.00    +0.000 C 
ATOM     18  O   LIG    1       -4.526   1.297  -0.459  0.00  0.00    +0.000 OA
ATOM     19  B   LIG    1       -3.186   1.430   0.095  0.00  0.00    +0.000 B 
ATOM     20  O   LIG    1       -3.078   0.889   1.440  0.00  0.00    +0.000 OA
ATOM     21  C   LIG    1       -3.550  -1.437   1.762  0.00  0.00    +0.000 C 
ENDBRANCH   1  19
BRANCH  11  22
ATOM     22  C   LIG    1        1.994   0.277   0.715  0.00  0.00    +0.000 C 
BRANCH  22  23
ATOM     23  N   LIG    1        3.396  -0.060   0.956  0.00  0.00    +0.000 N 
ATOM     24  C   LIG    1        4.005  -1.341   0.775  0.00  0.00    +0.000 C 
ATOM     25  O   LIG    1        3.365  -2.415   0.620  0.00  0.00    +0.000 OA
ATOM     26  C   LIG    1        5.457  -1.207   0.761  0.00  0.00    +0.000 A 
ATOM     27  C   LIG    1        5.755   0.133   0.904  0.00  0.00    +0.000 A 
ATOM     28  C   LIG    1        7.071   0.591   0.909  0.00  0.00    +0.000 A 
ATOM     29  C   LIG    1        8.100  -0.357   0.769  0.00  0.00    +0.000 A 
ATOM     30  C   LIG    1        7.796  -1.728   0.622  0.00  0.00    +0.000 A 
ATOM     31  C   LIG    1        6.459  -2.165   0.615  0.00  0.00    +0.000 A 
ATOM     32  C   LIG    1        4.493   0.857   1.010  0.00  0.00    +0.000 C 
ATOM     33  O   LIG    1        4.369   2.106   1.104  0.00  0.00    +0.000 OA
ENDBRANCH  22  23
ENDBRANCH  11  22
TORSDOF 3