REMARK  Name = BDB020504
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -3.520   0.570  -2.187  0.00  0.00    +0.041 C 
ATOM      2  C   LIG    1       -3.195   0.983  -0.755  0.00  0.00    +0.171 C 
ATOM      3  N   LIG    1       -2.095   0.208  -0.212  0.00  0.00    -0.318 N 
ATOM      4  C   LIG    1       -0.794   0.636  -0.249  0.00  0.00    +0.064 A 
ATOM      5  C   LIG    1       -0.081  -0.370   0.370  0.00  0.00    +0.094 A 
ATOM      6  N   LIG    1       -0.923  -1.392   0.750  0.00  0.00    -0.232 NA
ATOM      7  C   LIG    1       -0.464   1.912  -0.905  0.00  0.00    +0.163 C 
ATOM      8  N   LIG    1       -1.542   2.862  -0.652  0.00  0.00    -0.297 N 
ATOM      9  C   LIG    1       -1.212   4.271  -0.771  0.00  0.00    +0.132 C 
ATOM     10  C   LIG    1       -2.133  -1.006   0.409  0.00  0.00    +0.114 A 
ATOM     11  C   LIG    1       -2.882   2.481  -0.718  0.00  0.00    +0.238 C 
ATOM     12  O   LIG    1       -3.799   3.303  -0.780  0.00  0.00    -0.273 OA
ENDROOT
BRANCH   5  13
ATOM     13  C   LIG    1        1.352  -0.427   0.574  0.00  0.00    +0.003 A 
ATOM     14  C   LIG    1        2.042  -1.594   0.207  0.00  0.00    +0.021 A 
ATOM     15  C   LIG    1        3.433  -1.659   0.398  0.00  0.00    +0.020 A 
ATOM     16  C   LIG    1        4.444  -2.616   0.163  0.00  0.00    +0.143 A 
ATOM     17  N   LIG    1        5.655  -2.188   0.530  0.00  0.00    -0.179 NA
ATOM     18  N   LIG    1        5.418  -0.953   1.013  0.00  0.00    -0.267 N 
ATOM     19  C   LIG    1        6.516  -0.173   1.534  0.00  0.00    +0.173 C 
ATOM     20  C   LIG    1        4.098  -0.573   0.959  0.00  0.00    +0.069 A 
ATOM     21  C   LIG    1        3.432   0.594   1.355  0.00  0.00    +0.028 A 
ATOM     22  C   LIG    1        2.046   0.642   1.154  0.00  0.00    +0.012 A 
ENDBRANCH   5  13
BRANCH  10  23
ATOM     23  C   LIG    1       -3.409  -1.848   0.696  0.00  0.00    +0.055 C 
ATOM     24  C   LIG    1       -3.279  -3.340   0.867  0.00  0.00    +0.012 C 
ATOM     25  C   LIG    1       -3.921  -2.782  -0.369  0.00  0.00    +0.012 C 
ENDBRANCH  10  23
TORSDOF 2