REMARK  Name = BDB008452
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -4.186  -0.404  -0.414  0.00  0.00    +0.105 C 
ATOM      2  N   LIG    1       -2.736  -0.247  -0.493  0.00  0.00    -0.294 NA
ATOM      3  C   LIG    1       -2.057  -1.380   0.168  0.00  0.00    +0.138 C 
ATOM      4  C   LIG    1       -0.594  -1.127   0.143  0.00  0.00    +0.040 A 
ATOM      5  C   LIG    1       -0.003   0.113   0.057  0.00  0.00    +0.029 A 
ATOM      6  C   LIG    1       -0.804   1.295  -0.020  0.00  0.00    +0.085 A 
ATOM      7  N   LIG    1       -0.346   2.504  -0.106  0.00  0.00    -0.174 NA
ATOM      8  N   LIG    1        0.959   2.897  -0.167  0.00  0.00    -0.242 N 
ATOM      9  H   LIG    1        1.051   3.907  -0.247  0.00  0.00    +0.192 HD
ATOM     10  C   LIG    1        2.203   2.296  -0.141  0.00  0.00    +0.272 A 
ATOM     11  C   LIG    1        2.437   0.846  -0.033  0.00  0.00    +0.050 A 
ATOM     12  C   LIG    1        3.747   0.331  -0.013  0.00  0.00    +0.014 A 
ATOM     13  C   LIG    1        3.983  -1.042   0.083  0.00  0.00    +0.003 A 
ATOM     14  C   LIG    1        2.925  -1.952   0.160  0.00  0.00    +0.026 A 
ATOM     15  C   LIG    1        1.628  -1.429   0.140  0.00  0.00    +0.048 A 
ATOM     16  O   LIG    1        3.192   3.033  -0.211  0.00  0.00    -0.266 OA
ATOM     17  C   LIG    1        1.380  -0.056   0.049  0.00  0.00    +0.021 A 
ATOM     18  N   LIG    1        0.401  -2.064   0.193  0.00  0.00    -0.356 N 
ATOM     19  H   LIG    1        0.274  -3.066   0.246  0.00  0.00    +0.166 HD
ATOM     20  C   LIG    1       -2.328   1.070   0.078  0.00  0.00    +0.142 C 
ENDROOT
TORSDOF 0