REMARK  Name = BDB047634
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        2.834  -1.377  -0.139  0.00  0.00    +0.052 C 
ATOM      2  C   LIG    1        1.633  -0.439  -0.233  0.00  0.00    +0.179 C 
ATOM      3  O   LIG    1        0.608  -1.022   0.568  0.00  0.00    -0.487 OA
ATOM      4  C   LIG    1       -0.661  -0.573   0.337  0.00  0.00    +0.142 A 
ATOM      5  C   LIG    1       -1.057   0.679  -0.151  0.00  0.00    +0.076 A 
ATOM      6  C   LIG    1       -2.430   0.914  -0.353  0.00  0.00    +0.027 A 
ATOM      7  C   LIG    1       -3.389  -0.054  -0.048  0.00  0.00    +0.002 A 
ATOM      8  C   LIG    1       -2.990  -1.279   0.469  0.00  0.00    +0.004 A 
ATOM      9  N   LIG    1       -0.223   1.772  -0.454  0.00  0.00    -0.282 N 
ATOM     10  H   LIG    1       -0.669   2.599  -0.834  0.00  0.00    +0.155 HD
ATOM     11  C   LIG    1        1.110   1.971  -0.287  0.00  0.00    +0.221 C 
ATOM     12  O   LIG    1        1.587   3.059  -0.619  0.00  0.00    -0.275 OA
ATOM     13  C   LIG    1       -1.634  -1.531   0.662  0.00  0.00    +0.047 A 
ATOM     14  C   LIG    1        1.973   0.919   0.338  0.00  0.00    +0.140 C 
ENDROOT
TORSDOF 0