REMARK  Name = BDB013853
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        1.165   0.597  -0.452  0.00  0.00    -0.338 N 
ATOM      2  H   LIG    1        0.822  -0.371  -0.473  0.00  0.00    +0.146 HD
ENDROOT
BRANCH   1   4
ATOM      3  C   LIG    1        3.221  -0.469   0.391  0.00  0.00    +0.082 A 
ATOM      4  C   LIG    1        2.391   0.659   0.232  0.00  0.00    +0.060 A 
ATOM      5  C   LIG    1        2.947   1.867   0.666  0.00  0.00    +0.134 A 
ATOM      6  N   LIG    1        4.158   2.012   1.259  0.00  0.00    -0.261 NA
ATOM      7  C   LIG    1        4.902   0.901   1.402  0.00  0.00    +0.111 A 
ATOM      8  C   LIG    1        4.486  -0.346   0.983  0.00  0.00    +0.036 A 
BRANCH   3  10
ATOM      9  O   LIG    1        3.612  -2.779  -0.158  0.00  0.00    -0.245 OA
ATOM     10  C   LIG    1        2.842  -1.845  -0.022  0.00  0.00    +0.339 C 
BRANCH  10  11
ATOM     11  O   LIG    1        1.516  -2.018  -0.185  0.00  0.00    -0.477 OA
ATOM     12  H   LIG    1        1.432  -2.962  -0.438  0.00  0.00    +0.295 HD
ENDBRANCH  10  11
ENDBRANCH   3  10
ENDBRANCH   1   4
BRANCH   1  13
ATOM     13  C   LIG    1        0.110   1.535  -0.089  0.00  0.00    +0.137 C 
BRANCH  13  14
ATOM     14  C   LIG    1       -1.203   1.075  -0.691  0.00  0.00    -0.023 A 
ATOM     15  C   LIG    1       -2.019   0.081  -0.076  0.00  0.00    -0.013 A 
ATOM     16  C   LIG    1       -3.233  -0.290  -0.709  0.00  0.00    -0.018 A 
ATOM     17  C   LIG    1       -4.064  -1.260  -0.126  0.00  0.00    +0.008 A 
ATOM     18  C   LIG    1       -3.715  -1.879   1.073  0.00  0.00    +0.001 A 
ATOM     19  C   LIG    1       -2.527  -1.537   1.702  0.00  0.00    +0.001 A 
ATOM     20  C   LIG    1       -3.602   0.309  -1.923  0.00  0.00    +0.008 A 
ATOM     21  C   LIG    1       -2.788   1.262  -2.527  0.00  0.00    +0.001 A 
ATOM     22  C   LIG    1       -1.690  -0.572   1.136  0.00  0.00    +0.009 A 
ATOM     23  C   LIG    1       -1.596   1.638  -1.919  0.00  0.00    +0.006 A 
ENDBRANCH  13  14
ENDBRANCH   1  13
TORSDOF 5