REMARK  Name = BDB008450
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1        2.450   3.165   0.344  0.00  0.00    -0.266 OA
ATOM      2  C   LIG    1        1.516   2.360   0.246  0.00  0.00    +0.272 A 
ATOM      3  C   LIG    1        1.847   0.925   0.264  0.00  0.00    +0.050 A 
ATOM      4  C   LIG    1        0.859  -0.049   0.161  0.00  0.00    +0.021 A 
ATOM      5  C   LIG    1        1.196  -1.405   0.190  0.00  0.00    +0.048 A 
ATOM      6  C   LIG    1        2.519  -1.841   0.315  0.00  0.00    +0.026 A 
ATOM      7  C   LIG    1        3.510  -0.859   0.414  0.00  0.00    +0.003 A 
ATOM      8  N   LIG    1        0.020  -2.123   0.083  0.00  0.00    -0.356 N 
ATOM      9  H   LIG    1       -0.041  -3.132   0.091  0.00  0.00    +0.166 HD
ATOM     10  C   LIG    1       -1.031  -1.254  -0.019  0.00  0.00    +0.040 A 
ATOM     11  C   LIG    1       -2.466  -1.604  -0.147  0.00  0.00    +0.135 C 
ATOM     12  N   LIG    1       -3.268  -0.483   0.363  0.00  0.00    -0.305 NA
ATOM     13  H   LIG    1       -4.252  -0.664   0.175  0.00  0.00    +0.123 HD
ATOM     14  C   LIG    1       -2.892   0.818  -0.252  0.00  0.00    +0.139 C 
ATOM     15  C   LIG    1       -1.400   1.155  -0.048  0.00  0.00    +0.085 A 
ATOM     16  N   LIG    1       -1.028   2.395  -0.012  0.00  0.00    -0.174 NA
ATOM     17  C   LIG    1       -0.525   0.026   0.027  0.00  0.00    +0.029 A 
ATOM     18  C   LIG    1        3.183   0.499   0.390  0.00  0.00    +0.014 A 
ATOM     19  N   LIG    1        0.241   2.878   0.126  0.00  0.00    -0.242 N 
ATOM     20  H   LIG    1        0.264   3.895   0.140  0.00  0.00    +0.192 HD
ENDROOT
TORSDOF 0