REMARK  Name = BDB027687
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.550  -1.007  -0.328  0.00  0.00    +0.131 A 
ATOM      2  C   LIG    1        1.054  -2.293  -0.581  0.00  0.00    +0.043 A 
ATOM      3  C   LIG    1        2.445  -2.390  -0.637  0.00  0.00    +0.095 A 
ATOM      4  C   LIG    1        2.956  -3.653  -0.900  0.00  0.00    +0.139 A 
ATOM      5  N   LIG    1        2.231  -4.786  -1.097  0.00  0.00    -0.261 NA
ATOM      6  C   LIG    1        0.895  -4.659  -1.019  0.00  0.00    +0.111 A 
ATOM      7  N   LIG    1        3.260  -1.342  -0.448  0.00  0.00    -0.226 NA
ATOM      8  C   LIG    1        2.685  -0.160  -0.178  0.00  0.00    +0.162 A 
ATOM      9  C   LIG    1        0.267  -3.454  -0.768  0.00  0.00    +0.033 A 
ATOM     10  N   LIG    1        1.359   0.044  -0.110  0.00  0.00    -0.212 NA
ENDROOT
BRANCH   8  11
ATOM     11  C   LIG    1        3.570   0.998   0.053  0.00  0.00    +0.022 A 
ATOM     12  C   LIG    1        3.055   2.260   0.389  0.00  0.00    +0.031 A 
ATOM     13  C   LIG    1        3.925   3.319   0.596  0.00  0.00    +0.111 A 
ATOM     14  N   LIG    1        5.265   3.220   0.493  0.00  0.00    -0.263 NA
ATOM     15  C   LIG    1        5.756   2.006   0.173  0.00  0.00    +0.111 A 
ATOM     16  C   LIG    1        4.965   0.890  -0.052  0.00  0.00    +0.031 A 
ENDBRANCH   8  11
BRANCH   1  17
ATOM     17  N   LIG    1       -0.842  -0.814  -0.255  0.00  0.00    -0.326 N 
ATOM     18  H   LIG    1       -1.299  -1.196  -1.083  0.00  0.00    +0.148 HD
BRANCH  17  19
ATOM     19  C   LIG    1       -1.286   0.565  -0.029  0.00  0.00    +0.137 C 
BRANCH  19  20
ATOM     20  C   LIG    1       -2.814   0.644  -0.211  0.00  0.00    +0.081 C 
ATOM     21  C   LIG    1       -3.602  -0.174   0.813  0.00  0.00    +0.036 C 
ATOM     22  C   LIG    1       -5.009   0.422   0.777  0.00  0.00    +0.003 C 
ATOM     23  C   LIG    1       -4.862   1.839   0.221  0.00  0.00    +0.003 C 
ATOM     24  C   LIG    1       -3.366   2.053  -0.000  0.00  0.00    +0.036 C 
BRANCH  20  25
ATOM     25  O   LIG    1       -3.160   0.183  -1.529  0.00  0.00    -0.387 OA
ATOM     26  H   LIG    1       -2.806   0.826  -2.169  0.00  0.00    +0.210 HD
ENDBRANCH  20  25
ENDBRANCH  19  20
ENDBRANCH  17  19
ENDBRANCH   1  17
TORSDOF 5