REMARK  Name = BDB001006
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1        3.855  -2.038  -0.158  0.00  0.00    -0.270 OA
ATOM      2  C   LIG    1        2.697  -1.643  -0.138  0.00  0.00    +0.245 C 
ATOM      3  C   LIG    1        2.355  -0.196  -0.146  0.00  0.00    +0.044 A 
ATOM      4  C   LIG    1        1.017   0.210  -0.288  0.00  0.00    +0.016 A 
ATOM      5  C   LIG    1        0.708   1.567  -0.224  0.00  0.00    +0.133 A 
ATOM      6  C   LIG    1        1.720   2.516  -0.065  0.00  0.00    +0.046 A 
ATOM      7  C   LIG    1        3.050   2.111   0.050  0.00  0.00    +0.004 A 
ATOM      8  O   LIG    1       -0.578   2.042  -0.295  0.00  0.00    -0.455 OA
ATOM      9  C   LIG    1       -1.610   1.139  -0.170  0.00  0.00    +0.132 A 
ATOM     10  C   LIG    1       -1.440  -0.249  -0.261  0.00  0.00    +0.004 A 
ATOM     11  C   LIG    1       -2.574  -1.071  -0.159  0.00  0.00    +0.008 A 
ATOM     12  C   LIG    1       -3.838  -0.517   0.062  0.00  0.00    +0.001 A 
ATOM     13  C   LIG    1       -3.989   0.864   0.165  0.00  0.00    +0.004 A 
ATOM     14  C   LIG    1       -2.876   1.692   0.042  0.00  0.00    +0.046 A 
ATOM     15  C   LIG    1       -0.067  -0.804  -0.559  0.00  0.00    +0.074 C 
ATOM     16  C   LIG    1        0.289  -2.092   0.203  0.00  0.00    +0.117 C 
ATOM     17  C   LIG    1        3.369   0.754   0.016  0.00  0.00    +0.013 A 
ATOM     18  N   LIG    1        1.642  -2.525  -0.095  0.00  0.00    -0.310 N 
ATOM     19  H   LIG    1        1.912  -3.491   0.049  0.00  0.00    +0.149 HD
ENDROOT
TORSDOF 0