REMARK  Name = BDB015847
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.656   1.936  -0.247  0.00  0.00    +0.164 A 
ATOM      2  N   LIG    1       -0.067   0.804  -0.188  0.00  0.00    -0.193 NA
ATOM      3  C   LIG    1       -1.411   0.935  -0.202  0.00  0.00    +0.226 A 
ATOM      4  C   LIG    1       -2.073   2.151  -0.276  0.00  0.00    +0.065 A 
ATOM      5  C   LIG    1       -1.228   3.241  -0.337  0.00  0.00    +0.127 A 
ATOM      6  N   LIG    1        0.121   3.168  -0.322  0.00  0.00    -0.235 NA
ENDROOT
BRANCH   1   9
ATOM      7  C   LIG    1        4.161   0.427  -0.108  0.00  0.00    -0.014 A 
ATOM      8  C   LIG    1        2.763   0.560  -0.133  0.00  0.00    +0.020 A 
ATOM      9  C   LIG    1        2.128   1.817  -0.228  0.00  0.00    +0.020 A 
ATOM     10  C   LIG    1        2.959   2.950  -0.301  0.00  0.00    +0.011 A 
ATOM     11  C   LIG    1        4.351   2.837  -0.281  0.00  0.00    +0.001 A 
ATOM     12  C   LIG    1        4.948   1.581  -0.185  0.00  0.00    +0.008 A 
BRANCH   7  17
ATOM     13  C   LIG    1        7.279  -3.295   0.941  0.00  0.00    +0.172 C 
ATOM     14  N   LIG    1        6.156  -2.524   0.467  0.00  0.00    -0.274 N 
ATOM     15  N   LIG    1        5.140  -3.149  -0.154  0.00  0.00    -0.179 NA
ATOM     16  C   LIG    1        4.296  -2.156  -0.446  0.00  0.00    +0.142 A 
ATOM     17  C   LIG    1        4.764  -0.892  -0.013  0.00  0.00    +0.020 A 
ATOM     18  C   LIG    1        5.978  -1.175   0.579  0.00  0.00    +0.116 A 
ENDBRANCH   7  17
ENDBRANCH   1   9
BRANCH   4  19
ATOM     19  C   LIG    1       -3.517   2.297  -0.302  0.00  0.00    +0.026 A 
ATOM     20  C   LIG    1       -4.216   3.377   0.203  0.00  0.00    +0.116 A 
ATOM     21  N   LIG    1       -5.538   3.116  -0.016  0.00  0.00    -0.274 N 
ATOM     22  C   LIG    1       -6.661   3.948   0.345  0.00  0.00    +0.172 C 
ATOM     23  N   LIG    1       -5.756   1.946  -0.637  0.00  0.00    -0.179 NA
ATOM     24  C   LIG    1       -4.529   1.446  -0.805  0.00  0.00    +0.143 A 
ENDBRANCH   4  19
BRANCH   3  25
ATOM     25  O   LIG    1       -2.173  -0.216  -0.123  0.00  0.00    -0.475 OA
BRANCH  25  26
ATOM     26  C   LIG    1       -1.413  -1.421   0.008  0.00  0.00    +0.242 C 
BRANCH  26  27
ATOM     27  C   LIG    1       -2.387  -2.590   0.131  0.00  0.00    +0.049 C 
ATOM     28  C   LIG    1       -3.148  -2.926  -1.163  0.00  0.00    +0.172 C 
ATOM     29  O   LIG    1       -2.618  -4.272  -1.176  0.00  0.00    -0.378 OA
ATOM     30  C   LIG    1       -1.727  -3.964  -0.079  0.00  0.00    +0.172 C 
ATOM     31  C   LIG    1       -3.264  -2.519   1.377  0.00  0.00    +0.019 C 
ENDBRANCH  26  27
ENDBRANCH  25  26
ENDBRANCH   3  25
TORSDOF 6