REMARK  Name = BDB015959
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.400   0.151   0.135  0.00  0.00    +0.162 A 
ATOM      2  N   LIG    1       -0.725  -0.558  -0.078  0.00  0.00    -0.212 NA
ATOM      3  C   LIG    1       -1.908   0.088  -0.055  0.00  0.00    +0.131 A 
ATOM      4  C   LIG    1       -1.986   1.458   0.206  0.00  0.00    +0.043 A 
ATOM      5  C   LIG    1       -0.774   2.090   0.410  0.00  0.00    +0.125 A 
ATOM      6  N   LIG    1        0.423   1.473   0.374  0.00  0.00    -0.235 NA
ENDROOT
BRANCH   1   9
ATOM      7  C   LIG    1        4.149  -0.569   0.238  0.00  0.00    -0.014 A 
ATOM      8  C   LIG    1        2.915   0.103   0.269  0.00  0.00    +0.020 A 
ATOM      9  C   LIG    1        1.687  -0.572   0.102  0.00  0.00    +0.020 A 
ATOM     10  C   LIG    1        1.742  -1.964  -0.097  0.00  0.00    +0.011 A 
ATOM     11  C   LIG    1        2.958  -2.649  -0.128  0.00  0.00    +0.001 A 
ATOM     12  C   LIG    1        4.155  -1.954   0.039  0.00  0.00    +0.008 A 
BRANCH   7  17
ATOM     13  C   LIG    1        8.905   0.850  -0.001  0.00  0.00    +0.172 C 
ATOM     14  N   LIG    1        7.495   0.783   0.298  0.00  0.00    -0.274 N 
ATOM     15  N   LIG    1        6.929   1.755   1.034  0.00  0.00    -0.179 NA
ATOM     16  C   LIG    1        5.648   1.383   1.105  0.00  0.00    +0.142 A 
ATOM     17  C   LIG    1        5.387   0.172   0.421  0.00  0.00    +0.020 A 
ATOM     18  C   LIG    1        6.617  -0.185  -0.095  0.00  0.00    +0.116 A 
ENDBRANCH   7  17
ENDBRANCH   1   9
BRANCH   4  19
ATOM     19  C   LIG    1       -3.233   2.197   0.287  0.00  0.00    +0.024 A 
ATOM     20  C   LIG    1       -3.435   3.469  -0.209  0.00  0.00    +0.116 A 
ATOM     21  N   LIG    1       -4.735   3.785   0.068  0.00  0.00    -0.274 N 
ATOM     22  C   LIG    1       -5.420   5.013  -0.254  0.00  0.00    +0.172 C 
ATOM     23  N   LIG    1       -5.398   2.805   0.706  0.00  0.00    -0.179 NA
ATOM     24  C   LIG    1       -4.482   1.844   0.849  0.00  0.00    +0.143 A 
ENDBRANCH   4  19
BRANCH   3  25
ATOM     25  N   LIG    1       -3.089  -0.657  -0.276  0.00  0.00    -0.324 N 
ATOM     26  H   LIG    1       -3.628  -0.174  -0.993  0.00  0.00    +0.148 HD
BRANCH  25  27
ATOM     27  C   LIG    1       -2.909  -2.080  -0.603  0.00  0.00    +0.087 C 
ATOM     28  C   LIG    1       -4.239  -2.686  -1.103  0.00  0.00    +0.103 C 
ATOM     29  N   LIG    1       -4.394  -3.961  -0.398  0.00  0.00    -0.314 NA
ATOM     30  H   LIG    1       -5.378  -4.215  -0.330  0.00  0.00    +0.122 HD
ATOM     31  C   LIG    1       -3.839  -3.704   0.929  0.00  0.00    +0.083 C 
ATOM     32  C   LIG    1       -2.578  -2.912   0.640  0.00  0.00    +0.038 C 
ENDBRANCH  25  27
ENDBRANCH   3  25
TORSDOF 5