REMARK  Name = BDB000666
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1       -2.909   3.153   0.236  0.00  0.00    -0.283 OA
ATOM      2  C   LIG    1       -2.095   2.262   0.170  0.00  0.00    +0.234 C 
ATOM      3  C   LIG    1       -2.346   0.820   0.243  0.00  0.00    +0.034 A 
ATOM      4  C   LIG    1       -1.134   0.171   0.124  0.00  0.00    +0.005 A 
ATOM      5  C   LIG    1       -1.026  -1.215   0.154  0.00  0.00    -0.016 A 
ATOM      6  C   LIG    1       -2.226  -1.940   0.314  0.00  0.00    +0.008 A 
ATOM      7  C   LIG    1       -3.463  -1.270   0.434  0.00  0.00    +0.001 A 
ATOM      8  C   LIG    1        0.273  -1.744   0.022  0.00  0.00    +0.017 A 
ATOM      9  C   LIG    1        1.403  -0.901  -0.133  0.00  0.00    -0.017 A 
ATOM     10  C   LIG    1        1.251   0.514  -0.159  0.00  0.00    -0.006 A 
ATOM     11  C   LIG    1        2.393   1.326  -0.314  0.00  0.00    +0.009 A 
ATOM     12  C   LIG    1        3.660   0.758  -0.441  0.00  0.00    +0.001 A 
ATOM     13  C   LIG    1        3.808  -0.625  -0.416  0.00  0.00    +0.001 A 
ATOM     14  C   LIG    1        2.689  -1.447  -0.263  0.00  0.00    +0.008 A 
ATOM     15  C   LIG    1       -0.046   1.014  -0.026  0.00  0.00    +0.042 A 
ATOM     16  C   LIG    1       -3.532   0.128   0.399  0.00  0.00    +0.012 A 
ATOM     17  C   LIG    1       -0.564   2.398  -0.009  0.00  0.00    +0.234 C 
ATOM     18  O   LIG    1        0.050   3.434  -0.111  0.00  0.00    -0.283 OA
ENDROOT
TORSDOF 0