REMARK  Name = BDB027675
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.983   0.895   0.092  0.00  0.00    +0.131 A 
ATOM      2  C   LIG    1        1.268   2.135  -0.505  0.00  0.00    +0.043 A 
ATOM      3  C   LIG    1        2.622   2.418  -0.692  0.00  0.00    +0.095 A 
ATOM      4  C   LIG    1        2.914   3.635  -1.292  0.00  0.00    +0.139 A 
ATOM      5  N   LIG    1        2.011   4.565  -1.700  0.00  0.00    -0.261 NA
ATOM      6  C   LIG    1        0.718   4.269  -1.491  0.00  0.00    +0.111 A 
ATOM      7  N   LIG    1        3.602   1.584  -0.319  0.00  0.00    -0.226 NA
ATOM      8  C   LIG    1        3.234   0.437   0.272  0.00  0.00    +0.162 A 
ATOM      9  C   LIG    1        0.300   3.087  -0.907  0.00  0.00    +0.033 A 
ATOM     10  N   LIG    1        1.961   0.070   0.493  0.00  0.00    -0.212 NA
ENDROOT
BRANCH   8  11
ATOM     11  C   LIG    1        4.302  -0.484   0.704  0.00  0.00    +0.022 A 
ATOM     12  C   LIG    1        4.011  -1.704   1.334  0.00  0.00    +0.031 A 
ATOM     13  C   LIG    1        5.048  -2.537   1.723  0.00  0.00    +0.111 A 
ATOM     14  N   LIG    1        6.351  -2.252   1.533  0.00  0.00    -0.263 NA
ATOM     15  C   LIG    1        6.627  -1.080   0.927  0.00  0.00    +0.111 A 
ATOM     16  C   LIG    1        5.658  -0.183   0.505  0.00  0.00    +0.031 A 
ENDBRANCH   8  11
BRANCH   1  17
ATOM     17  N   LIG    1       -0.353   0.541   0.315  0.00  0.00    -0.321 N 
ATOM     18  H   LIG    1       -0.886   0.662  -0.549  0.00  0.00    +0.148 HD
BRANCH  17  20
ATOM     19  C   LIG    1       -0.304  -1.944   0.086  0.00  0.00    +0.033 C 
ATOM     20  C   LIG    1       -0.765  -0.742   0.927  0.00  0.00    +0.051 C 
ATOM     21  C   LIG    1       -0.288  -0.854   2.381  0.00  0.00    +0.033 C 
BRANCH  20  22
ATOM     22  C   LIG    1       -2.329  -0.721   0.942  0.00  0.00    +0.185 C 
BRANCH  22  23
ATOM     23  O   LIG    1       -2.811  -0.541  -0.399  0.00  0.00    -0.372 OA
BRANCH  23  24
ATOM     24  C   LIG    1       -4.235  -0.517  -0.583  0.00  0.00    +0.061 C 
ATOM     25  C   LIG    1       -4.885   0.644   0.179  0.00  0.00    +0.041 C 
ATOM     26  C   LIG    1       -4.435  -0.293  -2.089  0.00  0.00    +0.041 C 
ATOM     27  C   LIG    1       -4.875  -1.854  -0.194  0.00  0.00    +0.041 C 
ENDBRANCH  23  24
ENDBRANCH  22  23
ENDBRANCH  20  22
ENDBRANCH  17  20
ENDBRANCH   1  17
TORSDOF 6