REMARK  Name = BDB013065
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.725  -0.271  -0.140  0.00  0.00    +0.046 A 
ATOM      2  C   LIG    1        0.770  -0.511  -1.168  0.00  0.00    +0.173 A 
ATOM      3  N   LIG    1       -0.556  -0.475  -0.815  0.00  0.00    -0.253 N 
ATOM      4  C   LIG    1       -1.246  -0.799  -1.945  0.00  0.00    +0.232 A 
ATOM      5  N   LIG    1       -0.409  -0.967  -2.944  0.00  0.00    -0.137 NA
ATOM      6  C   LIG    1       -0.995  -0.194   0.482  0.00  0.00    +0.203 A 
ATOM      7  N   LIG    1       -0.120  -0.002   1.432  0.00  0.00    -0.223 NA
ATOM      8  N   LIG    1        0.866  -0.783  -2.454  0.00  0.00    -0.129 NA
ATOM      9  C   LIG    1        1.219  -0.054   1.096  0.00  0.00    +0.126 A 
ENDROOT
BRANCH   1  13
ATOM     10  C   LIG    1        5.924  -0.285  -0.686  0.00  0.00    +0.215 A 
ATOM     11  N   LIG    1        5.380   0.707   0.049  0.00  0.00    -0.221 NA
ATOM     12  C   LIG    1        4.033   0.680   0.197  0.00  0.00    +0.123 A 
ATOM     13  C   LIG    1        3.191  -0.298  -0.335  0.00  0.00    +0.005 A 
ATOM     14  C   LIG    1        3.801  -1.299  -1.097  0.00  0.00    +0.015 A 
ATOM     15  C   LIG    1        5.184  -1.297  -1.274  0.00  0.00    +0.068 A 
BRANCH  10  16
ATOM     16  O   LIG    1        7.289  -0.331  -0.886  0.00  0.00    -0.477 OA
BRANCH  16  18
ATOM     17  C   LIG    1        9.464   0.590  -0.575  0.00  0.00    +0.048 C 
ATOM     18  C   LIG    1        7.985   0.754  -0.272  0.00  0.00    +0.227 C 
ENDBRANCH  16  18
ENDBRANCH  10  16
ENDBRANCH   1  13
BRANCH   6  19
ATOM     19  N   LIG    1       -2.339  -0.139   0.777  0.00  0.00    -0.310 N 
ATOM     20  H   LIG    1       -2.429  -0.149   1.795  0.00  0.00    +0.149 HD
BRANCH  19  21
ATOM     21  C   LIG    1       -3.132   0.981   0.277  0.00  0.00    +0.140 C 
BRANCH  21  22
ATOM     22  C   LIG    1       -4.509   0.926   0.881  0.00  0.00    -0.024 A 
ATOM     23  C   LIG    1       -5.467   0.012   0.455  0.00  0.00    +0.002 A 
ATOM     24  C   LIG    1       -5.415  -0.994  -0.634  0.00  0.00    +0.080 C 
ATOM     25  C   LIG    1       -6.676  -1.790  -0.298  0.00  0.00    +0.234 C 
ATOM     26  O   LIG    1       -7.567  -0.958   0.478  0.00  0.00    -0.491 OA
ATOM     27  C   LIG    1       -6.734  -0.016   1.023  0.00  0.00    +0.124 A 
ATOM     28  C   LIG    1       -7.106   0.848   2.032  0.00  0.00    +0.046 A 
ATOM     29  C   LIG    1       -6.156   1.759   2.492  0.00  0.00    +0.004 A 
ATOM     30  C   LIG    1       -4.870   1.796   1.927  0.00  0.00    +0.005 A 
ENDBRANCH  21  22
ENDBRANCH  19  21
ENDBRANCH   6  19
TORSDOF 6