REMARK  Name = BDB046200
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1       -0.551  -2.861  -0.412  0.00  0.00    -0.270 OA
ATOM      2  C   LIG    1       -0.769  -1.678  -0.184  0.00  0.00    +0.244 C 
ATOM      3  C   LIG    1        0.334  -0.706   0.058  0.00  0.00    +0.041 A 
ATOM      4  C   LIG    1        0.056   0.669   0.172  0.00  0.00    -0.034 A 
ATOM      5  C   LIG    1        1.111   1.568   0.371  0.00  0.00    +0.006 A 
ATOM      6  C   LIG    1        2.421   1.096   0.477  0.00  0.00    +0.020 A 
ATOM      7  C   LIG    1        2.682  -0.271   0.372  0.00  0.00    +0.042 A 
ATOM      8 CL   LIG    1        4.302  -0.838   0.502  0.00  0.00    -0.084 Cl
ATOM      9  C   LIG    1       -1.358   1.166   0.011  0.00  0.00    +0.054 C 
ATOM     10  C   LIG    1       -2.350   0.096   0.457  0.00  0.00    +0.109 C 
ATOM     11  C   LIG    1        1.647  -1.176   0.160  0.00  0.00    +0.033 A 
ATOM     12  N   LIG    1       -2.051  -1.183  -0.143  0.00  0.00    -0.311 N 
ATOM     13  H   LIG    1       -2.768  -1.899  -0.186  0.00  0.00    +0.149 HD
ENDROOT
TORSDOF 0