REMARK  Name = BDB054139
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        3.275   0.432   0.024  0.00  0.00    +0.044 C 
ATOM      2  C   LIG    1        1.822   0.063  -0.042  0.00  0.00    -0.048 A 
ATOM      3  C   LIG    1        0.845   0.955   0.429  0.00  0.00    +0.032 A 
ATOM      4  C   LIG    1       -0.514   0.642   0.347  0.00  0.00    +0.078 A 
ATOM      5  C   LIG    1       -0.885  -0.578  -0.226  0.00  0.00    +0.065 A 
ATOM      6  C   LIG    1       -2.325  -0.883  -0.301  0.00  0.00    +0.259 A 
ATOM      7  N   LIG    1       -3.159   0.080   0.208  0.00  0.00    -0.313 N 
ATOM      8  H   LIG    1       -4.149  -0.117   0.162  0.00  0.00    +0.170 HD
ATOM      9  C   LIG    1       -2.702   1.246   0.748  0.00  0.00    +0.199 A 
ATOM     10  O   LIG    1       -2.752  -1.924  -0.786  0.00  0.00    -0.267 OA
ATOM     11  C   LIG    1        0.069  -1.473  -0.714  0.00  0.00    +0.015 A 
ATOM     12  N   LIG    1       -1.456   1.564   0.839  0.00  0.00    -0.237 NA
ATOM     13  C   LIG    1        1.423  -1.147  -0.625  0.00  0.00    +0.004 A 
ENDROOT
TORSDOF 0