REMARK  Name = BDB051282
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.962   0.704   0.157  0.00  0.00    +0.095 A 
ATOM      2  N   LIG    1        1.847  -0.269  -0.133  0.00  0.00    -0.164 NA
ATOM      3  N   LIG    1        3.054   0.314  -0.011  0.00  0.00    -0.215 N 
ATOM      4  C   LIG    1        2.974   1.634   0.349  0.00  0.00    +0.138 A 
ATOM      5  N   LIG    1        4.101   2.404   0.524  0.00  0.00    -0.307 N 
ATOM      6  H   LIG    1        4.041   3.379   0.790  0.00  0.00    +0.170 HD
ATOM      7  C   LIG    1        5.360   1.864   0.341  0.00  0.00    +0.259 A 
ATOM      8  C   LIG    1        5.442   0.424  -0.052  0.00  0.00    +0.065 A 
ATOM      9  C   LIG    1        6.688  -0.177  -0.252  0.00  0.00    +0.015 A 
ATOM     10  C   LIG    1        6.758  -1.524  -0.619  0.00  0.00    +0.001 A 
ATOM     11  C   LIG    1        5.589  -2.273  -0.787  0.00  0.00    +0.002 A 
ATOM     12  C   LIG    1        4.340  -1.684  -0.591  0.00  0.00    +0.028 A 
ATOM     13  O   LIG    1        6.372   2.540   0.494  0.00  0.00    -0.267 OA
ATOM     14  C   LIG    1        4.277  -0.338  -0.224  0.00  0.00    +0.080 A 
ATOM     15  C   LIG    1        1.640   1.922   0.467  0.00  0.00    +0.076 A 
ENDROOT
BRANCH   1  19
ATOM     16  C   LIG    1       -3.297  -0.058   0.076  0.00  0.00    -0.042 A 
ATOM     17  C   LIG    1       -2.361  -1.063  -0.225  0.00  0.00    +0.005 A 
ATOM     18  C   LIG    1       -0.983  -0.813  -0.198  0.00  0.00    +0.010 A 
ATOM     19  C   LIG    1       -0.485   0.453   0.131  0.00  0.00    +0.002 A 
ATOM     20  C   LIG    1       -1.409   1.459   0.432  0.00  0.00    +0.010 A 
ATOM     21  C   LIG    1       -2.790   1.208   0.404  0.00  0.00    +0.005 A 
BRANCH  16  23
ATOM     22  C   LIG    1       -5.700   0.840   0.391  0.00  0.00    +0.015 C 
ATOM     23  C   LIG    1       -4.804  -0.369   0.036  0.00  0.00    -0.013 C 
ATOM     24  C   LIG    1       -5.130  -1.490   1.046  0.00  0.00    +0.015 C 
ATOM     25  C   LIG    1       -5.202  -0.831  -1.382  0.00  0.00    +0.015 C 
ENDBRANCH  16  23
ENDBRANCH   1  19
TORSDOF 2