REMARK  Name = BDB055942
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1       -1.215   3.204  -0.284  0.00  0.00    -0.267 OA
ATOM      2  C   LIG    1       -0.609   2.142  -0.189  0.00  0.00    +0.258 A 
ATOM      3  C   LIG    1       -1.318   0.846  -0.080  0.00  0.00    +0.047 A 
ATOM      4  C   LIG    1       -0.588  -0.363   0.028  0.00  0.00    -0.001 A 
ATOM      5  C   LIG    1       -1.373  -1.526   0.125  0.00  0.00    +0.009 A 
ATOM      6  C   LIG    1       -2.777  -1.495   0.115  0.00  0.00    +0.001 A 
ATOM      7  C   LIG    1       -3.455  -0.291   0.007  0.00  0.00    +0.001 A 
ATOM      8  C   LIG    1        0.909  -0.312   0.032  0.00  0.00    +0.044 A 
ATOM      9  C   LIG    1        1.518   0.952  -0.075  0.00  0.00    +0.143 A 
ATOM     10  N   LIG    1        2.848   1.205  -0.090  0.00  0.00    -0.237 NA
ATOM     11  C   LIG    1        3.675   0.159   0.005  0.00  0.00    +0.114 A 
ATOM     12  C   LIG    1        3.222  -1.133   0.115  0.00  0.00    +0.040 A 
ATOM     13  C   LIG    1        1.839  -1.369   0.128  0.00  0.00    +0.054 A 
ATOM     14 CL   LIG    1        1.446  -3.049   0.272  0.00  0.00    -0.083 Cl
ATOM     15  C   LIG    1       -2.725   0.883  -0.091  0.00  0.00    +0.014 A 
ATOM     16  N   LIG    1        0.750   2.102  -0.178  0.00  0.00    -0.306 N 
ATOM     17  H   LIG    1        1.252   2.975  -0.252  0.00  0.00    +0.170 HD
ENDROOT
TORSDOF 0