REMARK  Name = BDB027693
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.011  -1.426   0.042  0.00  0.00    +0.135 A 
ATOM      2  C   LIG    1        0.625  -2.557   0.581  0.00  0.00    +0.043 A 
ATOM      3  C   LIG    1        1.968  -2.380   0.917  0.00  0.00    +0.095 A 
ATOM      4  C   LIG    1        2.614  -3.489   1.444  0.00  0.00    +0.139 A 
ATOM      5  N   LIG    1        2.058  -4.710   1.663  0.00  0.00    -0.261 NA
ATOM      6  C   LIG    1        0.760  -4.841   1.344  0.00  0.00    +0.111 A 
ATOM      7  N   LIG    1        2.619  -1.219   0.754  0.00  0.00    -0.226 NA
ATOM      8  C   LIG    1        1.922  -0.190   0.247  0.00  0.00    +0.162 A 
ATOM      9  C   LIG    1        0.009  -3.811   0.808  0.00  0.00    +0.033 A 
ATOM     10  N   LIG    1        0.633  -0.257  -0.114  0.00  0.00    -0.212 NA
ENDROOT
BRANCH   8  11
ATOM     11  C   LIG    1        2.616   1.098   0.070  0.00  0.00    +0.022 A 
ATOM     12  C   LIG    1        3.950   1.277   0.464  0.00  0.00    +0.031 A 
ATOM     13  C   LIG    1        4.558   2.509   0.278  0.00  0.00    +0.111 A 
ATOM     14  N   LIG    1        3.941   3.574  -0.271  0.00  0.00    -0.263 NA
ATOM     15  C   LIG    1        2.659   3.398  -0.650  0.00  0.00    +0.111 A 
ATOM     16  C   LIG    1        1.969   2.205  -0.503  0.00  0.00    +0.031 A 
ENDBRANCH   8  11
BRANCH   1  17
ATOM     17  N   LIG    1       -1.369  -1.529  -0.366  0.00  0.00    -0.299 N 
ATOM     18  H   LIG    1       -1.454  -2.289  -1.032  0.00  0.00    +0.154 HD
BRANCH  17  22
ATOM     19  C   LIG    1       -3.025   3.120   0.344  0.00  0.00    +0.044 C 
ATOM     20  C   LIG    1       -3.149   1.776  -0.310  0.00  0.00    -0.049 A 
ATOM     21  C   LIG    1       -2.206   0.771  -0.039  0.00  0.00    +0.026 A 
ATOM     22  C   LIG    1       -2.265  -0.479  -0.671  0.00  0.00    +0.033 A 
ATOM     23  C   LIG    1       -3.332  -0.723  -1.548  0.00  0.00    +0.023 A 
ATOM     24  C   LIG    1       -4.268   0.273  -1.837  0.00  0.00    +0.002 A 
ATOM     25  C   LIG    1       -4.170   1.522  -1.229  0.00  0.00    +0.003 A 
ENDBRANCH  17  22
ENDBRANCH   1  17
TORSDOF 3