REMARK  Name = BDB001116
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.928  -3.040  -0.287  0.00  0.00    +0.068 C 
ATOM      2  C   LIG    1        1.445  -1.651  -0.214  0.00  0.00    +0.069 A 
ATOM      3  C   LIG    1        0.745  -0.428  -0.089  0.00  0.00    +0.043 A 
ATOM      4  C   LIG    1        1.720   0.537  -0.051  0.00  0.00    +0.139 A 
ATOM      5  N   LIG    1        1.489   1.884   0.076  0.00  0.00    -0.307 N 
ATOM      6  H   LIG    1        2.226   2.574   0.097  0.00  0.00    +0.170 HD
ATOM      7  C   LIG    1        0.192   2.334   0.188  0.00  0.00    +0.254 A 
ATOM      8  C   LIG    1       -0.912   1.303   0.159  0.00  0.00    +0.021 A 
ATOM      9  C   LIG    1       -2.313   1.822   0.315  0.00  0.00    +0.041 C 
ATOM     10  C   LIG    1       -3.324   0.717   0.627  0.00  0.00    +0.005 C 
ATOM     11  C   LIG    1       -3.090  -0.503  -0.256  0.00  0.00    +0.005 C 
ATOM     12  C   LIG    1       -1.679  -1.071  -0.065  0.00  0.00    +0.036 C 
ATOM     13  O   LIG    1       -0.054   3.531   0.305  0.00  0.00    -0.268 OA
ATOM     14  N   LIG    1        2.914  -0.108  -0.161  0.00  0.00    -0.251 N 
ATOM     15  C   LIG    1        4.237   0.464  -0.184  0.00  0.00    +0.174 C 
ATOM     16  C   LIG    1       -0.615  -0.009   0.011  0.00  0.00    -0.027 A 
ATOM     17  N   LIG    1        2.773  -1.447  -0.270  0.00  0.00    -0.174 NA
ENDROOT
TORSDOF 0