REMARK  Name = BDB015226
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        0.084   1.691  -1.243  0.00  0.00    -0.341 N 
ATOM      2  H   LIG    1        0.146   1.723  -0.223  0.00  0.00    +0.146 HD
ENDROOT
BRANCH   1   5
ATOM      3  C   LIG    1        3.413   0.028  -1.463  0.00  0.00    +0.002 A 
ATOM      4  C   LIG    1        2.296   0.759  -1.007  0.00  0.00    +0.033 A 
ATOM      5  C   LIG    1        1.118   0.899  -1.762  0.00  0.00    +0.028 A 
ATOM      6  C   LIG    1        1.107   0.356  -3.048  0.00  0.00    +0.023 A 
ATOM      7  C   LIG    1        2.201  -0.362  -3.536  0.00  0.00    +0.002 A 
ATOM      8  C   LIG    1        3.339  -0.529  -2.748  0.00  0.00    +0.010 A 
BRANCH   3  16
ATOM      9  C   LIG    1        8.518   1.735   3.160  0.00  0.00    +0.172 C 
ATOM     10  N   LIG    1        7.660   1.054   2.220  0.00  0.00    -0.272 N 
ATOM     11  N   LIG    1        6.611   1.718   1.692  0.00  0.00    -0.151 NA
ATOM     12  C   LIG    1        6.041   0.823   0.882  0.00  0.00    +0.182 A 
ATOM     13  C   LIG    1        6.750  -0.414   0.912  0.00  0.00    +0.039 A 
ATOM     14  C   LIG    1        6.466  -1.576   0.218  0.00  0.00    +0.015 A 
ATOM     15  C   LIG    1        5.323  -1.371  -0.570  0.00  0.00    +0.029 A 
ATOM     16  C   LIG    1        4.614  -0.126  -0.609  0.00  0.00    +0.074 A 
ATOM     17  N   LIG    1        4.941   0.995   0.112  0.00  0.00    -0.226 NA
ATOM     18  C   LIG    1        7.790  -0.238   1.785  0.00  0.00    +0.118 A 
ENDBRANCH   3  16
ENDBRANCH   1   5
BRANCH   1  19
ATOM     19  C   LIG    1       -1.306   1.433  -1.637  0.00  0.00    +0.134 C 
BRANCH  19  20
ATOM     20  C   LIG    1       -1.885   0.219  -0.876  0.00  0.00    +0.145 C 
BRANCH  20  21
ATOM     21  O   LIG    1       -1.810   0.504   0.536  0.00  0.00    -0.389 OA
ATOM     22  H   LIG    1       -2.576   1.055   0.773  0.00  0.00    +0.210 HD
ENDBRANCH  20  21
BRANCH  20  23
ATOM     23  C   LIG    1       -3.348  -0.035  -1.326  0.00  0.00    +0.117 C 
BRANCH  23  24
ATOM     24  N   LIG    1       -3.909  -1.357  -0.977  0.00  0.00    -0.295 NA
ATOM     25  C   LIG    1       -3.918  -1.663   0.464  0.00  0.00    +0.120 C 
ATOM     26  C   LIG    1       -4.929  -0.865   1.257  0.00  0.00    -0.030 A 
ATOM     27  C   LIG    1       -6.112  -0.408   0.645  0.00  0.00    -0.042 A 
ATOM     28  C   LIG    1       -7.060   0.290   1.405  0.00  0.00    +0.004 A 
ATOM     29  C   LIG    1       -6.843   0.519   2.763  0.00  0.00    +0.000 A 
ATOM     30  C   LIG    1       -5.679   0.057   3.373  0.00  0.00    +0.000 A 
ATOM     31  C   LIG    1       -6.329  -0.605  -0.836  0.00  0.00    +0.051 C 
ATOM     32  C   LIG    1       -4.727  -0.637   2.625  0.00  0.00    +0.005 A 
ATOM     33  C   LIG    1       -5.281  -1.522  -1.494  0.00  0.00    +0.089 C 
ENDBRANCH  23  24
ENDBRANCH  20  23
ENDBRANCH  19  20
ENDBRANCH   1  19
TORSDOF 7