REMARK  Name = BDB046081
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1       -0.987  -3.175   0.274  0.00  0.00    -0.270 OA
ATOM      2  C   LIG    1       -0.998  -1.952   0.192  0.00  0.00    +0.245 C 
ATOM      3  C   LIG    1        0.260  -1.183   0.065  0.00  0.00    +0.046 A 
ATOM      4  C   LIG    1        0.096   0.193  -0.019  0.00  0.00    +0.016 A 
ATOM      5  C   LIG    1        1.175   1.047  -0.141  0.00  0.00    +0.048 A 
ATOM      6  C   LIG    1        2.483   0.556  -0.186  0.00  0.00    +0.026 A 
ATOM      7  C   LIG    1        2.644  -0.843  -0.100  0.00  0.00    +0.003 A 
ATOM      8  N   LIG    1        0.638   2.315  -0.195  0.00  0.00    -0.360 N 
ATOM      9  H   LIG    1        1.177   3.165  -0.285  0.00  0.00    +0.165 HD
ATOM     10  C   LIG    1       -0.742   2.253  -0.109  0.00  0.00    +0.088 A 
ATOM     11  C   LIG    1       -1.100   0.927   0.003  0.00  0.00    -0.005 A 
ATOM     12  C   LIG    1       -2.394   0.217   0.128  0.00  0.00    +0.142 C 
ATOM     13  C   LIG    1        1.549  -1.711   0.024  0.00  0.00    +0.014 A 
ATOM     14  N   LIG    1       -2.189  -1.240   0.215  0.00  0.00    -0.307 N 
ATOM     15  H   LIG    1       -3.008  -1.825   0.303  0.00  0.00    +0.149 HD
ENDROOT
TORSDOF 0