REMARK  Name = BDB027659
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.296  -0.918  -0.380  0.00  0.00    +0.131 A 
ATOM      2  C   LIG    1        0.276  -1.992  -1.079  0.00  0.00    +0.043 A 
ATOM      3  C   LIG    1        1.662  -1.935  -1.222  0.00  0.00    +0.095 A 
ATOM      4  C   LIG    1        2.244  -2.983  -1.921  0.00  0.00    +0.139 A 
ATOM      5  N   LIG    1        1.590  -4.045  -2.463  0.00  0.00    -0.261 NA
ATOM      6  C   LIG    1        0.258  -4.076  -2.290  0.00  0.00    +0.111 A 
ATOM      7  N   LIG    1        2.410  -0.941  -0.721  0.00  0.00    -0.226 NA
ATOM      8  C   LIG    1        1.772   0.026  -0.043  0.00  0.00    +0.162 A 
ATOM      9  C   LIG    1       -0.438  -3.090  -1.617  0.00  0.00    +0.033 A 
ATOM     10  N   LIG    1        0.445   0.071   0.144  0.00  0.00    -0.212 NA
ENDROOT
BRANCH   8  11
ATOM     11  C   LIG    1        2.583   1.117   0.531  0.00  0.00    +0.022 A 
ATOM     12  C   LIG    1        1.997   2.148   1.282  0.00  0.00    +0.031 A 
ATOM     13  C   LIG    1        2.797   3.154   1.801  0.00  0.00    +0.111 A 
ATOM     14  N   LIG    1        4.133   3.212   1.631  0.00  0.00    -0.263 NA
ATOM     15  C   LIG    1        4.692   2.219   0.910  0.00  0.00    +0.111 A 
ATOM     16  C   LIG    1        3.973   1.173   0.352  0.00  0.00    +0.031 A 
ENDBRANCH   8  11
BRANCH   1  17
ATOM     17  N   LIG    1       -1.708  -0.874  -0.201  0.00  0.00    -0.323 N 
ATOM     18  H   LIG    1       -2.127  -0.954  -1.124  0.00  0.00    +0.148 HD
BRANCH  17  20
ATOM     19  C   LIG    1       -2.099  -0.058   2.089  0.00  0.00    +0.031 C 
ATOM     20  C   LIG    1       -2.384   0.123   0.604  0.00  0.00    +0.031 C 
ATOM     21  C   LIG    1       -2.287   1.557   0.008  0.00  0.00    +0.025 C 
ATOM     22  C   LIG    1       -3.797   1.712   0.274  0.00  0.00    +0.004 C 
ATOM     23  C   LIG    1       -3.903   0.174   0.254  0.00  0.00    +0.025 C 
ENDBRANCH  17  20
ENDBRANCH   1  17
TORSDOF 3