REMARK  Name = BDB057330
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -3.970   0.056   1.568  0.00  0.00    +0.141 C 
ATOM      2  N   LIG    1       -3.125   0.164   0.404  0.00  0.00    -0.242 N 
ATOM      3  C   LIG    1       -3.483   0.539  -0.848  0.00  0.00    +0.187 C 
ATOM      4  N   LIG    1       -2.512   0.605  -1.706  0.00  0.00    -0.213 NA
ATOM      5  C   LIG    1       -1.384   0.257  -0.990  0.00  0.00    +0.130 C 
ATOM      6  C   LIG    1       -0.159   0.226  -1.532  0.00  0.00    +0.041 C 
ATOM      7  C   LIG    1       -1.773  -0.035   0.424  0.00  0.00    +0.271 C 
ATOM      8  O   LIG    1       -1.069  -0.365   1.358  0.00  0.00    -0.268 OA
ENDROOT
BRANCH   6   9
ATOM      9  C   LIG    1        1.097  -0.121  -0.863  0.00  0.00    -0.019 A 
ATOM     10  C   LIG    1        2.122   0.833  -0.808  0.00  0.00    +0.057 A 
ATOM     11  C   LIG    1        3.309   0.474  -0.204  0.00  0.00    +0.167 A 
ATOM     12  O   LIG    1        4.401   1.273  -0.060  0.00  0.00    -0.453 OA
ATOM     13  C   LIG    1        5.298   0.383   0.636  0.00  0.00    +0.466 C 
ATOM     14  O   LIG    1        4.741  -0.928   0.870  0.00  0.00    -0.453 OA
ATOM     15  C   LIG    1        3.504  -0.780   0.325  0.00  0.00    +0.166 A 
ATOM     16  C   LIG    1        2.524  -1.746   0.278  0.00  0.00    +0.050 A 
ATOM     17  C   LIG    1        1.309  -1.410  -0.328  0.00  0.00    +0.012 A 
ENDBRANCH   6   9
BRANCH   3  18
ATOM     18  N   LIG    1       -4.769   0.812  -1.177  0.00  0.00    -0.331 N 
ATOM     19  H   LIG    1       -4.906   0.854  -2.182  0.00  0.00    +0.145 HD
ATOM     20  H   LIG    1       -5.479   0.271  -0.704  0.00  0.00    +0.145 HD
ENDBRANCH   3  18
TORSDOF 2