REMARK  Name = BDB034435
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        4.738  -0.342   0.216  0.00  0.00    -0.016 A 
ATOM      2  C   LIG    1        4.099  -1.532  -0.168  0.00  0.00    +0.037 A 
ATOM      3  C   LIG    1        2.789  -1.835   0.185  0.00  0.00    +0.073 A 
ATOM      4  C   LIG    1        2.044  -0.909   0.951  0.00  0.00    +0.021 A 
ATOM      5  C   LIG    1        0.692  -1.238   1.274  0.00  0.00    +0.038 A 
ATOM      6  C   LIG    1        0.224  -2.497   0.894  0.00  0.00    +0.043 A 
ATOM      7  C   LIG    1        1.042  -3.327   0.151  0.00  0.00    +0.113 A 
ATOM      8  C   LIG    1        2.689   0.284   1.355  0.00  0.00    +0.012 A 
ATOM      9  N   LIG    1        2.296  -3.014  -0.218  0.00  0.00    -0.255 NA
ATOM     10  C   LIG    1        4.009   0.562   0.992  0.00  0.00    +0.009 A 
ENDROOT
BRANCH   1  14
ATOM     11  C   LIG    1        8.803   0.479  -0.936  0.00  0.00    +0.120 A 
ATOM     12  C   LIG    1        7.848   0.137  -1.894  0.00  0.00    +0.046 A 
ATOM     13  C   LIG    1        6.527  -0.132  -1.522  0.00  0.00    +0.012 A 
ATOM     14  C   LIG    1        6.128  -0.062  -0.179  0.00  0.00    -0.018 A 
ATOM     15  C   LIG    1        7.099   0.283   0.774  0.00  0.00    +0.012 A 
ATOM     16  C   LIG    1        8.423   0.551   0.402  0.00  0.00    +0.046 A 
BRANCH  11  18
ATOM     17  C   LIG    1       11.067   1.049  -0.493  0.00  0.00    +0.277 C 
ATOM     18  O   LIG    1       10.054   0.715  -1.434  0.00  0.00    -0.495 OA
ENDBRANCH  11  18
ENDBRANCH   1  14
BRANCH   5  19
ATOM     19  N   LIG    1       -0.081  -0.359   2.053  0.00  0.00    -0.343 N 
ATOM     20  H   LIG    1        0.143   0.612   1.853  0.00  0.00    +0.146 HD
BRANCH  19  21
ATOM     21  C   LIG    1       -1.511  -0.554   2.281  0.00  0.00    +0.103 C 
BRANCH  21  22
ATOM     22  C   LIG    1       -2.335  -0.167   1.053  0.00  0.00    +0.034 C 
BRANCH  22  23
ATOM     23  C   LIG    1       -3.831  -0.308   1.340  0.00  0.00    +0.083 C 
BRANCH  23  24
ATOM     24  N   LIG    1       -4.599   0.038   0.146  0.00  0.00    -0.312 NA
ATOM     25  H   LIG    1       -4.397   0.999  -0.132  0.00  0.00    +0.122 HD
BRANCH  24  26
ATOM     26  C   LIG    1       -6.041  -0.076   0.392  0.00  0.00    +0.120 C 
BRANCH  26  27
ATOM     27  C   LIG    1       -6.841   0.292  -0.829  0.00  0.00    +0.012 A 
ATOM     28  C   LIG    1       -7.904   1.179  -0.769  0.00  0.00    +0.171 A 
ATOM     29  O   LIG    1       -8.343   1.834   0.343  0.00  0.00    -0.452 OA
ATOM     30  C   LIG    1       -9.443   2.594  -0.197  0.00  0.00    +0.466 C 
ATOM     31  O   LIG    1       -9.647   2.385  -1.608  0.00  0.00    -0.453 OA
ATOM     32  C   LIG    1       -8.655   1.496  -1.881  0.00  0.00    +0.167 A 
ATOM     33  C   LIG    1       -8.398   0.946  -3.118  0.00  0.00    +0.049 A 
ATOM     34  C   LIG    1       -7.341   0.040  -3.217  0.00  0.00    +0.004 A 
ATOM     35  C   LIG    1       -6.574  -0.287  -2.084  0.00  0.00    +0.009 A 
ENDBRANCH  26  27
ENDBRANCH  24  26
ENDBRANCH  23  24
ENDBRANCH  22  23
ENDBRANCH  21  22
ENDBRANCH  19  21
ENDBRANCH   5  19
TORSDOF 9