REMARK  Name = BDB026811
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.321   0.958  -0.018  0.00  0.00    +0.156 C 
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1       -1.172   2.114  -0.535  0.00  0.00    -0.023 A 
ATOM      3  C   LIG    1       -1.230   2.349  -1.921  0.00  0.00    +0.005 A 
ATOM      4  C   LIG    1       -1.992   3.396  -2.441  0.00  0.00    +0.000 A 
ATOM      5  C   LIG    1       -2.696   4.236  -1.583  0.00  0.00    +0.000 A 
ATOM      6  C   LIG    1       -2.631   4.035  -0.207  0.00  0.00    +0.000 A 
ATOM      7  C   LIG    1       -1.868   2.987   0.316  0.00  0.00    +0.005 A 
ENDBRANCH   1   2
BRANCH   1   9
ATOM      8  O   LIG    1       -0.270   0.934   2.396  0.00  0.00    -0.290 OA
ATOM      9  C   LIG    1       -0.766   0.443   1.373  0.00  0.00    +0.186 C 
BRANCH   9  10
ATOM     10  C   LIG    1       -1.758  -0.637   1.487  0.00  0.00    +0.044 A 
ATOM     11  C   LIG    1       -2.674  -1.214   0.537  0.00  0.00    +0.010 A 
ATOM     12  C   LIG    1       -3.365  -2.237   1.199  0.00  0.00    +0.047 A 
ATOM     13  C   LIG    1       -4.340  -3.033   0.581  0.00  0.00    +0.026 A 
ATOM     14  C   LIG    1       -4.638  -2.779  -0.757  0.00  0.00    +0.002 A 
ATOM     15  C   LIG    1       -3.987  -1.764  -1.447  0.00  0.00    +0.001 A 
ATOM     16  N   LIG    1       -2.910  -2.273   2.493  0.00  0.00    -0.360 N 
ATOM     17  H   LIG    1       -3.242  -2.913   3.202  0.00  0.00    +0.165 HD
ATOM     18  C   LIG    1       -3.013  -0.980  -0.815  0.00  0.00    +0.011 A 
ATOM     19  C   LIG    1       -1.958  -1.315   2.680  0.00  0.00    +0.095 A 
ENDBRANCH   9  10
ENDBRANCH   1   9
BRANCH   1  20
ATOM     20  N   LIG    1        1.100   1.406   0.028  0.00  0.00    -0.303 NA
ATOM     21  H   LIG    1        1.199   1.964   0.883  0.00  0.00    +0.123 HD
BRANCH  20  22
ATOM     22  C   LIG    1        2.030   0.269   0.093  0.00  0.00    +0.088 C 
BRANCH  22  23
ATOM     23  C   LIG    1        3.475   0.770   0.181  0.00  0.00    +0.070 C 
BRANCH  23  24
ATOM     24  C   LIG    1        4.447  -0.381   0.129  0.00  0.00    +0.042 A 
ATOM     25  N   LIG    1        4.568  -1.136   1.248  0.00  0.00    -0.260 NA
ATOM     26  C   LIG    1        5.431  -2.175   1.208  0.00  0.00    +0.111 A 
ATOM     27  C   LIG    1        6.183  -2.509   0.095  0.00  0.00    +0.020 A 
ATOM     28  C   LIG    1        6.044  -1.730  -1.047  0.00  0.00    +0.003 A 
ATOM     29  C   LIG    1        5.164  -0.651  -1.034  0.00  0.00    +0.023 A 
ENDBRANCH  23  24
ENDBRANCH  22  23
ENDBRANCH  20  22
ENDBRANCH   1  20
TORSDOF 7