REMARK  Name = BDB056918
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -3.849   2.716   0.383  0.00  0.00    +0.217 A 
ATOM      2  N   LIG    1       -4.018   1.487  -0.126  0.00  0.00    -0.195 NA
ATOM      3  C   LIG    1       -2.867   0.818  -0.289  0.00  0.00    +0.164 A 
ATOM      4  C   LIG    1       -1.597   1.281  -0.008  0.00  0.00    +0.065 A 
ATOM      5  C   LIG    1       -0.719   0.217  -0.362  0.00  0.00    +0.105 A 
ATOM      6  N   LIG    1       -1.406  -0.820  -0.873  0.00  0.00    -0.168 NA
ATOM      7  C   LIG    1       -1.524   2.575   0.485  0.00  0.00    +0.128 A 
ATOM      8  N   LIG    1       -2.706  -0.454  -0.761  0.00  0.00    -0.241 N 
ATOM      9  N   LIG    1       -2.664   3.280   0.681  0.00  0.00    -0.222 NA
ENDROOT
BRANCH   5  10
ATOM     10  C   LIG    1        0.735   0.165  -0.260  0.00  0.00    +0.021 A 
ATOM     11  C   LIG    1        1.494  -0.487  -1.222  0.00  0.00    +0.123 A 
ATOM     12  N   LIG    1        2.851  -0.565  -1.211  0.00  0.00    -0.240 NA
ATOM     13  C   LIG    1        3.519   0.002  -0.184  0.00  0.00    +0.121 A 
ATOM     14  C   LIG    1        2.826   0.673   0.827  0.00  0.00    +0.044 A 
ATOM     15  C   LIG    1        1.431   0.751   0.793  0.00  0.00    +0.015 A 
BRANCH  13  16
ATOM     16  N   LIG    1        4.926  -0.052  -0.142  0.00  0.00    -0.313 N 
ATOM     17  C   LIG    1        5.515  -0.535  -1.410  0.00  0.00    +0.121 C 
ATOM     18  C   LIG    1        7.059  -0.518  -1.325  0.00  0.00    +0.100 C 
ATOM     19  N   LIG    1        7.591  -1.298  -0.186  0.00  0.00    -0.313 NA
ATOM     20  H   LIG    1        7.291  -2.266  -0.307  0.00  0.00    +0.122 HD
ATOM     21  C   LIG    1        6.979  -0.782   1.055  0.00  0.00    +0.100 C 
ATOM     22  C   LIG    1        5.432  -0.783   1.038  0.00  0.00    +0.121 C 
ENDBRANCH  13  16
ENDBRANCH   5  10
BRANCH   1  24
ATOM     23  C   LIG    1       -6.059   3.337  -0.267  0.00  0.00    +0.128 C 
ATOM     24  N   LIG    1       -4.952   3.519   0.644  0.00  0.00    -0.316 N 
ATOM     25  H   LIG    1       -4.594   4.465   0.716  0.00  0.00    +0.149 HD
ENDBRANCH   1  24
BRANCH   8  26
ATOM     26  C   LIG    1       -3.749  -1.339  -1.240  0.00  0.00    +0.207 C 
BRANCH  26  27
ATOM     27  C   LIG    1       -4.455  -2.123  -0.136  0.00  0.00    +0.271 C 
ATOM     28  O   LIG    1       -3.548  -2.883   0.672  0.00  0.00    -0.347 OA
ATOM     29  C   LIG    1       -4.098  -2.800   1.986  0.00  0.00    +0.191 C 
ATOM     30  C   LIG    1       -4.740  -1.439   2.009  0.00  0.00    +0.191 C 
ATOM     31  O   LIG    1       -5.282  -1.298   0.696  0.00  0.00    -0.347 OA
ENDBRANCH  26  27
ENDBRANCH   8  26
TORSDOF 5