REMARK  Name = BDB008424
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -2.648   0.697  -1.210  0.00  0.00    +0.011 C 
ATOM      2  C   LIG    1       -2.523  -0.073   0.121  0.00  0.00    -0.024 C 
ATOM      3  C   LIG    1       -1.754   0.783   1.173  0.00  0.00    +0.060 C 
ATOM      4  C   LIG    1       -0.294   0.747   0.888  0.00  0.00    +0.027 A 
ATOM      5  C   LIG    1        0.369  -0.208   0.148  0.00  0.00    +0.027 A 
ATOM      6  C   LIG    1       -0.318  -1.317  -0.443  0.00  0.00    +0.071 A 
ATOM      7  N   LIG    1        0.223  -2.235  -1.177  0.00  0.00    -0.175 NA
ATOM      8  N   LIG    1        1.526  -2.343  -1.553  0.00  0.00    -0.242 N 
ATOM      9  H   LIG    1        1.690  -3.157  -2.140  0.00  0.00    +0.192 HD
ATOM     10  C   LIG    1        2.704  -1.661  -1.328  0.00  0.00    +0.272 A 
ATOM     11  C   LIG    1        2.827  -0.438  -0.517  0.00  0.00    +0.050 A 
ATOM     12  C   LIG    1        4.080   0.184  -0.356  0.00  0.00    +0.014 A 
ATOM     13  C   LIG    1        4.218   1.351   0.396  0.00  0.00    +0.003 A 
ATOM     14  C   LIG    1        3.112   1.943   1.012  0.00  0.00    +0.026 A 
ATOM     15  C   LIG    1        1.873   1.316   0.845  0.00  0.00    +0.048 A 
ATOM     16  O   LIG    1        3.731  -2.110  -1.850  0.00  0.00    -0.266 OA
ATOM     17  C   LIG    1        1.722   0.143   0.100  0.00  0.00    +0.021 A 
ATOM     18  N   LIG    1        0.625   1.664   1.318  0.00  0.00    -0.357 N 
ATOM     19  H   LIG    1        0.430   2.478   1.886  0.00  0.00    +0.166 HD
ATOM     20  C   LIG    1       -1.812  -1.437  -0.122  0.00  0.00    +0.064 C 
ATOM     21  C   LIG    1       -3.944  -0.342   0.650  0.00  0.00    +0.011 C 
ENDROOT
TORSDOF 0