REMARK  Name = BDB036973
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1       -5.032   0.717  -0.206  0.00  0.00    -0.275 OA
ATOM      2  C   LIG    1       -3.813   0.575  -0.192  0.00  0.00    +0.219 C 
ATOM      3  N   LIG    1       -3.070   0.707  -1.338  0.00  0.00    -0.255 N 
ATOM      4  H   LIG    1       -3.590   0.912  -2.181  0.00  0.00    +0.158 HD
ATOM      5  C   LIG    1       -1.699   0.647  -1.479  0.00  0.00    +0.242 C 
ATOM      6  O   LIG    1       -1.197   0.863  -2.579  0.00  0.00    -0.273 OA
ATOM      7  C   LIG    1       -0.907   0.378  -0.206  0.00  0.00    +0.175 C 
ATOM      8  C   LIG    1       -1.746  -0.420   0.795  0.00  0.00    +0.044 C 
ATOM      9  C   LIG    1       -3.044   0.317   1.080  0.00  0.00    +0.099 C 
ENDROOT
BRANCH   7  10
ATOM     10  N   LIG    1        0.366  -0.293  -0.457  0.00  0.00    -0.320 N 
ATOM     11  C   LIG    1        1.550   0.068   0.140  0.00  0.00    +0.141 A 
ATOM     12  C   LIG    1        2.534  -0.815  -0.297  0.00  0.00    +0.019 A 
ATOM     13  C   LIG    1        3.839  -0.623   0.182  0.00  0.00    +0.013 A 
ATOM     14  C   LIG    1        4.055   0.434   1.066  0.00  0.00    +0.020 A 
ATOM     15  C   LIG    1        2.983   1.236   1.430  0.00  0.00    +0.113 A 
ATOM     16  C   LIG    1        1.902  -1.742  -1.167  0.00  0.00    +0.029 A 
ATOM     17  N   LIG    1        1.708   1.096   1.001  0.00  0.00    -0.237 NA
ATOM     18  C   LIG    1        0.565  -1.410  -1.234  0.00  0.00    +0.089 A 
ENDBRANCH   7  10
TORSDOF 1