REMARK  Name = BDB050434
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.937   0.001   0.756  0.00  0.00    +0.051 A 
ATOM      2  C   LIG    1       -1.016   0.440  -0.214  0.00  0.00    +0.008 A 
ATOM      3  C   LIG    1       -1.300   1.658  -0.868  0.00  0.00    -0.038 A 
ATOM      4  C   LIG    1       -0.380   2.233  -1.912  0.00  0.00    +0.044 C 
ATOM      5  C   LIG    1       -2.463   2.358  -0.528  0.00  0.00    +0.047 A 
ATOM      6  C   LIG    1       -3.312   1.841   0.435  0.00  0.00    +0.117 A 
ATOM      7  N   LIG    1       -3.066   0.692   1.076  0.00  0.00    -0.237 NA
ENDROOT
BRANCH   2   8
ATOM      8  C   LIG    1        0.205  -0.312  -0.522  0.00  0.00    +0.008 A 
ATOM      9  C   LIG    1        1.393  -0.090   0.202  0.00  0.00    +0.055 A 
ATOM     10  C   LIG    1        2.580  -0.778  -0.055  0.00  0.00    +0.003 A 
ATOM     11  C   LIG    1        3.566  -0.301   0.868  0.00  0.00    -0.025 A 
ATOM     12  C   LIG    1        2.952   0.656   1.651  0.00  0.00    +0.087 A 
ATOM     13  C   LIG    1        4.978  -0.750   0.963  0.00  0.00    +0.046 C 
ATOM     14  C   LIG    1        2.593  -1.736  -1.088  0.00  0.00    +0.010 A 
ATOM     15  C   LIG    1        1.429  -1.973  -1.827  0.00  0.00    +0.001 A 
ATOM     16  N   LIG    1        1.651   0.775   1.244  0.00  0.00    -0.360 N 
ATOM     17  H   LIG    1        0.967   1.404   1.643  0.00  0.00    +0.165 HD
ATOM     18  C   LIG    1        0.259  -1.271  -1.548  0.00  0.00    +0.010 A 
ENDBRANCH   2   8
BRANCH   6  19
ATOM     19  N   LIG    1       -4.465   2.526   0.808  0.00  0.00    -0.343 N 
ATOM     20  H   LIG    1       -5.052   2.724   0.007  0.00  0.00    +0.144 HD
ATOM     21  H   LIG    1       -4.942   1.938   1.488  0.00  0.00    +0.144 HD
ENDBRANCH   6  19
BRANCH   1  23
ATOM     22  C   LIG    1       -2.493  -2.445   0.836  0.00  0.00    +0.010 C 
ATOM     23  C   LIG    1       -1.764  -1.295   1.514  0.00  0.00    +0.053 C 
ENDBRANCH   1  23
TORSDOF 3