REMARK  Name = BDB008413
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -2.724  -1.216  -0.768  0.00  0.00    +0.017 C 
ATOM      2  C   LIG    1       -2.234  -0.249   0.323  0.00  0.00    +0.010 C 
ATOM      3  C   LIG    1       -0.736  -0.569   0.607  0.00  0.00    +0.076 A 
ATOM      4  N   LIG    1       -0.453  -1.522   1.437  0.00  0.00    -0.175 NA
ATOM      5  N   LIG    1        0.767  -1.986   1.811  0.00  0.00    -0.242 N 
ATOM      6  H   LIG    1        0.699  -2.740   2.491  0.00  0.00    +0.192 HD
ATOM      7  C   LIG    1        2.086  -1.724   1.507  0.00  0.00    +0.272 A 
ATOM      8  C   LIG    1        2.538  -0.701   0.553  0.00  0.00    +0.050 A 
ATOM      9  C   LIG    1        1.636   0.113  -0.129  0.00  0.00    +0.021 A 
ATOM     10  C   LIG    1        2.111   1.077  -1.024  0.00  0.00    +0.048 A 
ATOM     11  C   LIG    1        3.474   1.266  -1.273  0.00  0.00    +0.026 A 
ATOM     12  C   LIG    1        4.371   0.445  -0.586  0.00  0.00    +0.003 A 
ATOM     13  N   LIG    1        1.012   1.729  -1.543  0.00  0.00    -0.357 N 
ATOM     14  H   LIG    1        1.055   2.481  -2.218  0.00  0.00    +0.166 HD
ATOM     15  C   LIG    1       -0.125   1.203  -0.998  0.00  0.00    +0.026 A 
ATOM     16  C   LIG    1       -1.507   1.648  -1.300  0.00  0.00    +0.055 C 
ATOM     17  C   LIG    1        3.914  -0.521   0.311  0.00  0.00    +0.014 A 
ATOM     18  O   LIG    1        2.948  -2.401   2.079  0.00  0.00    -0.266 OA
ATOM     19  C   LIG    1        0.237   0.197  -0.127  0.00  0.00    +0.027 A 
ATOM     20  C   LIG    1       -2.416   1.232  -0.131  0.00  0.00    +0.019 C 
ATOM     21  C   LIG    1       -3.077  -0.462   1.593  0.00  0.00    +0.017 C 
ENDROOT
TORSDOF 0