REMARK  Name = BDB026862
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.275   1.077   0.205  0.00  0.00    +0.156 C 
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1       -0.279   2.487   0.050  0.00  0.00    -0.023 A 
ATOM      3  C   LIG    1       -0.208   3.384   1.129  0.00  0.00    +0.005 A 
ATOM      4  C   LIG    1       -0.703   4.684   1.011  0.00  0.00    +0.000 A 
ATOM      5  C   LIG    1       -1.266   5.109  -0.190  0.00  0.00    +0.000 A 
ATOM      6  C   LIG    1       -1.325   4.239  -1.276  0.00  0.00    +0.000 A 
ATOM      7  C   LIG    1       -0.829   2.938  -1.161  0.00  0.00    +0.005 A 
ENDBRANCH   1   2
BRANCH   1   9
ATOM      8  O   LIG    1       -0.350  -0.439  -1.583  0.00  0.00    -0.290 OA
ATOM      9  C   LIG    1       -0.638   0.014  -0.469  0.00  0.00    +0.186 C 
BRANCH   9  10
ATOM     10  C   LIG    1       -1.848  -0.433   0.237  0.00  0.00    +0.044 A 
ATOM     11  C   LIG    1       -2.771  -1.451  -0.184  0.00  0.00    +0.010 A 
ATOM     12  C   LIG    1       -3.771  -1.544   0.785  0.00  0.00    +0.047 A 
ATOM     13  C   LIG    1       -4.840  -2.444   0.693  0.00  0.00    +0.026 A 
ATOM     14  C   LIG    1       -4.891  -3.280  -0.426  0.00  0.00    +0.002 A 
ATOM     15  C   LIG    1       -3.911  -3.215  -1.412  0.00  0.00    +0.001 A 
ATOM     16  N   LIG    1       -3.480  -0.619   1.757  0.00  0.00    -0.360 N 
ATOM     17  H   LIG    1       -4.043  -0.459   2.581  0.00  0.00    +0.165 HD
ATOM     18  C   LIG    1       -2.850  -2.308  -1.303  0.00  0.00    +0.011 A 
ATOM     19  C   LIG    1       -2.327   0.051   1.443  0.00  0.00    +0.095 A 
ENDBRANCH   9  10
ENDBRANCH   1   9
BRANCH   1  20
ATOM     20  N   LIG    1        1.651   1.032  -0.361  0.00  0.00    -0.303 NA
ATOM     21  H   LIG    1        1.547   0.972  -1.378  0.00  0.00    +0.123 HD
BRANCH  20  22
ATOM     22  C   LIG    1        2.399  -0.139   0.112  0.00  0.00    +0.086 C 
BRANCH  22  23
ATOM     23  C   LIG    1        3.794  -0.181  -0.528  0.00  0.00    +0.053 C 
BRANCH  23  24
ATOM     24  C   LIG    1        4.591  -1.348  -0.057  0.00  0.00    -0.009 A 
ATOM     25  C   LIG    1        4.659  -2.613  -0.602  0.00  0.00    +0.108 A 
ATOM     26  N   LIG    1        5.517  -3.325   0.184  0.00  0.00    -0.284 N 
ATOM     27  H   LIG    1        5.807  -4.292   0.082  0.00  0.00    +0.188 HD
ATOM     28  N   LIG    1        6.012  -2.616   1.210  0.00  0.00    -0.182 NA
ATOM     29  C   LIG    1        5.456  -1.413   1.060  0.00  0.00    +0.137 A 
ENDBRANCH  23  24
ENDBRANCH  22  23
ENDBRANCH  20  22
ENDBRANCH   1  20
TORSDOF 7