REMARK  Name = BDB000643
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.755  -1.770   0.158  0.00  0.00    +0.046 C 
ATOM      2  C   LIG    1       -1.054  -0.450   0.090  0.00  0.00    -0.027 A 
ATOM      3  C   LIG    1        0.323  -0.349  -0.024  0.00  0.00    +0.048 A 
ATOM      4  N   LIG    1        1.250  -1.387  -0.091  0.00  0.00    -0.278 N 
ATOM      5  H   LIG    1        1.042  -2.375  -0.067  0.00  0.00    +0.155 HD
ATOM      6  C   LIG    1        2.538  -0.903  -0.201  0.00  0.00    +0.289 C 
ATOM      7  C   LIG    1        2.394   0.643  -0.201  0.00  0.00    +0.249 C 
ATOM      8  O   LIG    1        3.274   1.468  -0.280  0.00  0.00    -0.282 OA
ATOM      9  O   LIG    1        3.569  -1.531  -0.280  0.00  0.00    -0.266 OA
ATOM     10  C   LIG    1        0.956   0.894  -0.085  0.00  0.00    +0.050 A 
ATOM     11  C   LIG    1        0.271   2.090  -0.039  0.00  0.00    +0.033 A 
ATOM     12  C   LIG    1       -1.114   2.007   0.075  0.00  0.00    +0.042 A 
ATOM     13 CL   LIG    1       -2.046   3.453   0.140  0.00  0.00    -0.084 Cl
ATOM     14  C   LIG    1       -1.772   0.760   0.139  0.00  0.00    +0.025 A 
ENDROOT
TORSDOF 0