REMARK  Name = BDB026809
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.664   0.241  -0.063  0.00  0.00    +0.156 C 
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1       -0.716   1.750   0.139  0.00  0.00    -0.023 A 
ATOM      3  C   LIG    1       -1.271   2.612  -0.821  0.00  0.00    +0.005 A 
ATOM      4  C   LIG    1       -1.294   3.992  -0.610  0.00  0.00    +0.000 A 
ATOM      5  C   LIG    1       -0.750   4.531   0.554  0.00  0.00    +0.000 A 
ATOM      6  C   LIG    1       -0.173   3.692   1.504  0.00  0.00    +0.000 A 
ATOM      7  C   LIG    1       -0.150   2.312   1.296  0.00  0.00    +0.005 A 
ENDBRANCH   1   2
BRANCH   1   8
ATOM      8  N   LIG    1        0.539  -0.093  -0.866  0.00  0.00    -0.303 NA
ATOM      9  H   LIG    1        0.325   0.136  -1.840  0.00  0.00    +0.123 HD
BRANCH   8  10
ATOM     10  C   LIG    1        0.893  -1.516  -0.777  0.00  0.00    +0.086 C 
BRANCH  10  11
ATOM     11  C   LIG    1        2.198  -1.825  -1.530  0.00  0.00    +0.050 C 
BRANCH  11  15
ATOM     12  C   LIG    1        5.747  -0.635   0.645  0.00  0.00    +0.120 A 
ATOM     13  C   LIG    1        4.996   0.314  -0.046  0.00  0.00    +0.046 A 
ATOM     14  C   LIG    1        3.851  -0.073  -0.752  0.00  0.00    +0.007 A 
ATOM     15  C   LIG    1        3.441  -1.412  -0.777  0.00  0.00    -0.046 A 
ATOM     16  C   LIG    1        4.197  -2.359  -0.077  0.00  0.00    +0.007 A 
ATOM     17  C   LIG    1        5.341  -1.971   0.625  0.00  0.00    +0.046 A 
BRANCH  12  19
ATOM     18  C   LIG    1        7.341   0.953   1.408  0.00  0.00    +0.277 C 
ATOM     19  O   LIG    1        6.881  -0.392   1.372  0.00  0.00    -0.495 OA
ENDBRANCH  12  19
ENDBRANCH  11  15
ENDBRANCH  10  11
ENDBRANCH   8  10
ENDBRANCH   1   8
BRANCH   1  20
ATOM     20  C   LIG    1       -1.956  -0.309  -0.731  0.00  0.00    +0.186 C 
ATOM     21  O   LIG    1       -1.975  -0.562  -1.940  0.00  0.00    -0.290 OA
BRANCH  20  22
ATOM     22  C   LIG    1       -3.151  -0.512   0.102  0.00  0.00    +0.044 A 
ATOM     23  C   LIG    1       -4.404  -1.085  -0.306  0.00  0.00    +0.010 A 
ATOM     24  C   LIG    1       -5.254  -1.079   0.801  0.00  0.00    +0.047 A 
ATOM     25  C   LIG    1       -6.565  -1.570   0.758  0.00  0.00    +0.026 A 
ATOM     26  C   LIG    1       -7.025  -2.087  -0.456  0.00  0.00    +0.002 A 
ATOM     27  C   LIG    1       -6.206  -2.108  -1.581  0.00  0.00    +0.001 A 
ATOM     28  N   LIG    1       -4.556  -0.521   1.844  0.00  0.00    -0.360 N 
ATOM     29  H   LIG    1       -4.931  -0.380   2.772  0.00  0.00    +0.165 HD
ATOM     30  C   LIG    1       -4.899  -1.613  -1.519  0.00  0.00    +0.011 A 
ATOM     31  C   LIG    1       -3.292  -0.180   1.439  0.00  0.00    +0.095 A 
ENDBRANCH  20  22
ENDBRANCH   1  20
TORSDOF 8