REMARK  Name = BDB016286
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -3.638   2.060   0.600  0.00  0.00    +0.052 C 
ATOM      2  C   LIG    1       -2.901   1.571  -0.645  0.00  0.00    +0.179 C 
ATOM      3  O   LIG    1       -1.751   0.793  -0.348  0.00  0.00    -0.486 OA
ATOM      4  C   LIG    1       -1.859  -0.430   0.247  0.00  0.00    +0.149 A 
ATOM      5  C   LIG    1       -2.982  -1.270   0.289  0.00  0.00    +0.076 A 
ATOM      6  C   LIG    1       -2.900  -2.477   1.011  0.00  0.00    +0.027 A 
ATOM      7  C   LIG    1       -1.726  -2.872   1.652  0.00  0.00    +0.003 A 
ATOM      8  C   LIG    1       -0.604  -2.062   1.580  0.00  0.00    +0.011 A 
ATOM      9  N   LIG    1       -4.230  -1.059  -0.325  0.00  0.00    -0.282 N 
ATOM     10  H   LIG    1       -4.961  -1.733  -0.127  0.00  0.00    +0.155 HD
ATOM     11  C   LIG    1       -4.668  -0.115  -1.192  0.00  0.00    +0.221 C 
ATOM     12  O   LIG    1       -5.838  -0.168  -1.579  0.00  0.00    -0.275 OA
ATOM     13  C   LIG    1       -0.662  -0.850   0.882  0.00  0.00    +0.019 A 
ATOM     14  C   LIG    1       -3.736   0.924  -1.723  0.00  0.00    +0.140 C 
ENDROOT
BRANCH  13  15
ATOM     15  C   LIG    1        0.562  -0.029   0.847  0.00  0.00    +0.015 C 
ATOM     16  C   LIG    1        1.527  -0.120  -0.092  0.00  0.00    -0.039 C 
ATOM     17  C   LIG    1        2.753   0.731  -0.045  0.00  0.00    -0.019 A 
ATOM     18  C   LIG    1        3.929   0.308  -0.703  0.00  0.00    -0.040 A 
ATOM     19  C   LIG    1        5.083   1.111  -0.664  0.00  0.00    +0.004 A 
ATOM     20  C   LIG    1        5.085   2.324   0.019  0.00  0.00    +0.000 A 
ATOM     21  C   LIG    1        3.929   2.757   0.655  0.00  0.00    +0.001 A 
ATOM     22  C   LIG    1        3.979  -0.963  -1.517  0.00  0.00    +0.036 C 
ATOM     23  C   LIG    1        2.811  -1.903  -1.249  0.00  0.00    +0.009 C 
ATOM     24  C   LIG    1        2.773   1.971   0.617  0.00  0.00    +0.008 A 
ATOM     25  C   LIG    1        1.502  -1.127  -1.222  0.00  0.00    +0.036 C 
ENDBRANCH  13  15
TORSDOF 1