REMARK  Name = BDB002593
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.642  -2.233   0.003  0.00  0.00    +0.064 A 
ATOM      2  C   LIG    1        1.386  -1.194  -0.591  0.00  0.00    +0.102 A 
ATOM      3  C   LIG    1        2.605  -1.545  -1.225  0.00  0.00    +0.091 A 
ATOM      4  N   LIG    1        3.393  -0.639  -1.821  0.00  0.00    -0.244 NA
ATOM      5  C   LIG    1        3.000   0.642  -1.809  0.00  0.00    +0.090 A 
ATOM      6  C   LIG    1        1.796   1.026  -1.189  0.00  0.00    +0.090 A 
ATOM      7  C   LIG    1        1.445   2.373  -1.211  0.00  0.00    +0.030 A 
ATOM      8  C   LIG    1        2.250   3.335  -1.826  0.00  0.00    +0.002 A 
ATOM      9  C   LIG    1        3.434   2.947  -2.434  0.00  0.00    +0.002 A 
ATOM     10  C   LIG    1        3.798   1.601  -2.420  0.00  0.00    +0.030 A 
ATOM     11  C   LIG    1        3.039  -2.861  -1.254  0.00  0.00    +0.030 A 
ATOM     12  C   LIG    1        2.302  -3.880  -0.669  0.00  0.00    +0.003 A 
ATOM     13  N   LIG    1        0.998   0.114  -0.585  0.00  0.00    -0.243 NA
ATOM     14  C   LIG    1        1.108  -3.565  -0.043  0.00  0.00    +0.015 A 
ENDROOT
BRANCH   1  17
ATOM     15  N   LIG    1       -1.163  -0.739   0.782  0.00  0.00    -0.281 N 
ATOM     16  H   LIG    1       -0.587  -0.026   0.338  0.00  0.00    +0.155 HD
ATOM     17  C   LIG    1       -0.667  -2.027   0.712  0.00  0.00    +0.250 C 
ATOM     18  O   LIG    1       -1.211  -3.023   1.185  0.00  0.00    -0.270 OA
BRANCH  15  21
ATOM     19  C   LIG    1       -1.826   2.091   0.693  0.00  0.00    +0.045 C 
ATOM     20  C   LIG    1       -2.702   1.069   1.359  0.00  0.00    -0.029 A 
ATOM     21  C   LIG    1       -2.368  -0.303   1.394  0.00  0.00    +0.037 A 
ATOM     22  C   LIG    1       -3.248  -1.183   2.038  0.00  0.00    +0.023 A 
ATOM     23  C   LIG    1       -4.429  -0.727   2.634  0.00  0.00    +0.002 A 
ATOM     24  C   LIG    1       -4.752   0.622   2.596  0.00  0.00    +0.000 A 
ATOM     25  C   LIG    1       -3.894   1.515   1.962  0.00  0.00    +0.005 A 
ENDBRANCH  15  21
ENDBRANCH   1  17
TORSDOF 2