REMARK  Name = BDB058235
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1       -0.660  -1.259   2.332  0.00  0.00    -0.267 OA
ATOM      2  C   LIG    1       -0.161  -0.765   1.328  0.00  0.00    +0.265 A 
ATOM      3  N   LIG    1       -0.979  -0.051   0.444  0.00  0.00    -0.258 N 
ATOM      4  C   LIG    1       -0.478   0.531  -0.706  0.00  0.00    +0.149 A 
ATOM      5  N   LIG    1       -1.422   1.149  -1.385  0.00  0.00    -0.227 NA
ATOM      6  C   LIG    1       -2.571   0.966  -0.660  0.00  0.00    +0.090 A 
ATOM      7  C   LIG    1       -3.872   1.418  -0.933  0.00  0.00    +0.031 A 
ATOM      8  C   LIG    1       -4.900   1.104  -0.035  0.00  0.00    +0.022 A 
ATOM      9  C   LIG    1       -4.635   0.355   1.111  0.00  0.00    +0.043 A 
ATOM     10  C   LIG    1       -3.347  -0.106   1.404  0.00  0.00    +0.048 A 
ATOM     11 CL   LIG    1       -5.924  -0.012   2.194  0.00  0.00    -0.083 Cl
ATOM     12  C   LIG    1        0.943   0.414  -1.034  0.00  0.00    +0.026 A 
ATOM     13  C   LIG    1        1.784  -0.304  -0.150  0.00  0.00    +0.005 A 
ATOM     14  C   LIG    1        3.159  -0.428  -0.448  0.00  0.00    -0.016 A 
ATOM     15  C   LIG    1        3.662   0.165  -1.617  0.00  0.00    +0.008 A 
ATOM     16  C   LIG    1        2.822   0.871  -2.482  0.00  0.00    +0.001 A 
ATOM     17  C   LIG    1        3.991  -1.142   0.432  0.00  0.00    +0.008 A 
ATOM     18  C   LIG    1        3.479  -1.729   1.593  0.00  0.00    +0.001 A 
ATOM     19  C   LIG    1        2.125  -1.612   1.895  0.00  0.00    +0.014 A 
ATOM     20  C   LIG    1        1.466   0.996  -2.191  0.00  0.00    +0.012 A 
ATOM     21  C   LIG    1       -2.332   0.219   0.492  0.00  0.00    +0.078 A 
ATOM     22  C   LIG    1        1.289  -0.904   1.028  0.00  0.00    +0.048 A 
ENDROOT
TORSDOF 0