REMARK  Name = BDB047069
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        2.280  -2.751   0.017  0.00  0.00    +0.113 C 
ATOM      2  C   LIG    1        0.899  -2.361   0.438  0.00  0.00    +0.229 C 
ATOM      3  N   LIG    1        0.520  -1.026   0.197  0.00  0.00    -0.277 N 
ATOM      4  C   LIG    1        1.301   0.134   0.350  0.00  0.00    +0.057 A 
ATOM      5  C   LIG    1        0.447   1.240   0.221  0.00  0.00    +0.004 A 
ATOM      6  C   LIG    1        0.966   2.543   0.374  0.00  0.00    +0.010 A 
ATOM      7  C   LIG    1        2.319   2.724   0.663  0.00  0.00    +0.001 A 
ATOM      8  C   LIG    1        3.153   1.626   0.813  0.00  0.00    +0.002 A 
ATOM      9  C   LIG    1       -0.849   0.746  -0.054  0.00  0.00    -0.011 A 
ATOM     10  C   LIG    1       -2.126   1.485  -0.269  0.00  0.00    +0.038 C 
ATOM     11  C   LIG    1       -3.312   0.551   0.011  0.00  0.00    +0.013 C 
ATOM     12  C   LIG    1       -3.201  -0.762  -0.775  0.00  0.00    +0.081 C 
ATOM     13  C   LIG    1       -1.851  -1.465  -0.626  0.00  0.00    +0.180 C 
ATOM     14  O   LIG    1       -1.713  -2.621  -1.019  0.00  0.00    -0.290 OA
ATOM     15  C   LIG    1        2.661   0.324   0.672  0.00  0.00    +0.027 A 
ATOM     16  C   LIG    1       -0.761  -0.628  -0.158  0.00  0.00    +0.096 A 
ATOM     17  O   LIG    1        0.114  -3.116   0.998  0.00  0.00    -0.273 OA
ENDROOT
TORSDOF 0