REMARK  Name = BDB051909
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.252   1.009  -0.034  0.00  0.00    +0.139 A 
ATOM      2  C   LIG    1       -0.451  -0.103  -0.896  0.00  0.00    +0.071 A 
ATOM      3  C   LIG    1        0.820  -0.599  -1.115  0.00  0.00    +0.127 A 
ATOM      4  N   LIG    1        1.692   0.146  -0.364  0.00  0.00    -0.238 N 
ATOM      5  N   LIG    1        1.038   1.113   0.330  0.00  0.00    -0.163 NA
ENDROOT
BRANCH   4   6
ATOM      6  C   LIG    1        3.103  -0.003  -0.252  0.00  0.00    +0.065 A 
ATOM      7  C   LIG    1        3.788  -0.997  -0.966  0.00  0.00    +0.028 A 
ATOM      8  C   LIG    1        5.175  -1.122  -0.836  0.00  0.00    +0.002 A 
ATOM      9  C   LIG    1        5.883  -0.262   0.001  0.00  0.00    +0.000 A 
ATOM     10  C   LIG    1        5.210   0.728   0.713  0.00  0.00    +0.002 A 
ATOM     11  C   LIG    1        3.825   0.860   0.589  0.00  0.00    +0.028 A 
ENDBRANCH   4   6
BRANCH   1  13
ATOM     12  C   LIG    1       -0.808   3.018   1.442  0.00  0.00    +0.093 C 
ATOM     13  C   LIG    1       -1.245   1.991   0.426  0.00  0.00    +0.181 C 
ATOM     14  O   LIG    1       -2.397   1.999  -0.008  0.00  0.00    -0.291 OA
ENDBRANCH   1  13
BRANCH   2  15
ATOM     15  C   LIG    1       -1.655  -0.636  -1.509  0.00  0.00    +0.197 C 
ATOM     16  O   LIG    1       -1.681  -0.934  -2.700  0.00  0.00    -0.287 OA
BRANCH  15  17
ATOM     17  C   LIG    1       -2.853  -0.910  -0.667  0.00  0.00    +0.022 A 
ATOM     18  C   LIG    1       -2.742  -1.258   0.687  0.00  0.00    +0.012 A 
ATOM     19  C   LIG    1       -3.891  -1.532   1.433  0.00  0.00    +0.001 A 
ATOM     20  C   LIG    1       -5.148  -1.471   0.830  0.00  0.00    +0.000 A 
ATOM     21  C   LIG    1       -5.261  -1.142  -0.520  0.00  0.00    +0.001 A 
ATOM     22  C   LIG    1       -4.116  -0.868  -1.270  0.00  0.00    +0.012 A 
ENDBRANCH  15  17
ENDBRANCH   2  15
TORSDOF 4