REMARK  Name = BDB000766
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        4.076   0.342  -0.006  0.00  0.00    +0.162 A 
ATOM      2  C   LIG    1        3.149  -0.709   0.083  0.00  0.00    +0.171 A 
ATOM      3  C   LIG    1        1.758  -0.447   0.217  0.00  0.00    +0.044 A 
ATOM      4  C   LIG    1        0.854  -1.480   0.408  0.00  0.00    +0.098 A 
ATOM      5  N   LIG    1       -0.477  -1.292   0.554  0.00  0.00    -0.349 N 
ATOM      6  C   LIG    1       -1.057  -0.059   0.366  0.00  0.00    +0.057 A 
ATOM      7  C   LIG    1       -0.160   1.061   0.298  0.00  0.00    +0.007 A 
ATOM      8  C   LIG    1       -0.724   2.350   0.332  0.00  0.00    +0.011 A 
ATOM      9  C   LIG    1       -2.097   2.560   0.383  0.00  0.00    +0.009 A 
ATOM     10  C   LIG    1       -2.984   1.495   0.316  0.00  0.00    -0.012 A 
ATOM     11  C   LIG    1       -4.359   1.792   0.280  0.00  0.00    +0.058 A 
ATOM     12  C   LIG    1       -5.253   0.764   0.119  0.00  0.00    +0.167 A 
ATOM     13  O   LIG    1       -6.602   0.874   0.042  0.00  0.00    -0.453 OA
ATOM     14  C   LIG    1       -6.978  -0.502  -0.177  0.00  0.00    +0.466 C 
ATOM     15  O   LIG    1       -5.841  -1.396  -0.220  0.00  0.00    -0.453 OA
ATOM     16  C   LIG    1       -4.821  -0.520  -0.023  0.00  0.00    +0.167 A 
ATOM     17  C   LIG    1       -3.478  -0.847   0.018  0.00  0.00    +0.060 A 
ATOM     18  C   LIG    1       -2.490   0.154   0.252  0.00  0.00    +0.010 A 
ATOM     19  C   LIG    1       -1.210  -2.459   1.095  0.00  0.00    +0.149 C 
ATOM     20  C   LIG    1        1.257   0.861   0.202  0.00  0.00    -0.004 A 
ATOM     21  C   LIG    1        2.216   1.896   0.070  0.00  0.00    +0.013 A 
ATOM     22  C   LIG    1        3.591   1.645  -0.025  0.00  0.00    +0.050 A 
ENDROOT
BRANCH   1  24
ATOM     23  C   LIG    1        6.354   1.082  -0.052  0.00  0.00    +0.277 C 
ATOM     24  O   LIG    1        5.403   0.022  -0.037  0.00  0.00    -0.491 OA
ENDBRANCH   1  24
BRANCH   2  25
ATOM     25  O   LIG    1        3.493  -2.045   0.121  0.00  0.00    -0.491 OA
ATOM     26  C   LIG    1        4.535  -2.449  -0.770  0.00  0.00    +0.277 C 
ENDBRANCH   2  25
TORSDOF 2