REMARK  Name = BDB015867
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.150   1.477   0.411  0.00  0.00    +0.162 A 
ATOM      2  N   LIG    1       -0.524   0.335   0.182  0.00  0.00    -0.212 NA
ATOM      3  C   LIG    1       -1.867   0.397   0.040  0.00  0.00    +0.132 A 
ATOM      4  C   LIG    1       -2.551   1.609   0.087  0.00  0.00    +0.060 A 
ATOM      5  C   LIG    1       -1.767   2.718   0.348  0.00  0.00    +0.126 A 
ATOM      6  N   LIG    1       -0.428   2.686   0.513  0.00  0.00    -0.235 NA
ENDROOT
BRANCH   1   9
ATOM      7  C   LIG    1        3.692   0.058   0.536  0.00  0.00    -0.014 A 
ATOM      8  C   LIG    1        2.298   0.165   0.397  0.00  0.00    +0.020 A 
ATOM      9  C   LIG    1        1.616   1.389   0.564  0.00  0.00    +0.020 A 
ATOM     10  C   LIG    1        2.393   2.519   0.879  0.00  0.00    +0.011 A 
ATOM     11  C   LIG    1        3.779   2.432   1.023  0.00  0.00    +0.001 A 
ATOM     12  C   LIG    1        4.424   1.208   0.853  0.00  0.00    +0.008 A 
BRANCH   7  17
ATOM     13  C   LIG    1        7.054  -3.453  -0.490  0.00  0.00    +0.172 C 
ATOM     14  N   LIG    1        5.846  -2.767  -0.104  0.00  0.00    -0.274 N 
ATOM     15  N   LIG    1        4.765  -3.481   0.252  0.00  0.00    -0.179 NA
ATOM     16  C   LIG    1        3.853  -2.546   0.530  0.00  0.00    +0.142 A 
ATOM     17  C   LIG    1        4.344  -1.229   0.359  0.00  0.00    +0.020 A 
ATOM     18  C   LIG    1        5.647  -1.417  -0.058  0.00  0.00    +0.116 A 
ENDBRANCH   7  17
ENDBRANCH   1   9
BRANCH   4  19
ATOM     19  C   LIG    1       -3.984   1.766  -0.126  0.00  0.00    +0.097 A 
ATOM     20  N   LIG    1       -4.694   2.674   0.565  0.00  0.00    -0.171 NA
ATOM     21  N   LIG    1       -5.951   2.545   0.107  0.00  0.00    -0.274 N 
ATOM     22  C   LIG    1       -6.993   3.384   0.649  0.00  0.00    +0.172 C 
ATOM     23  C   LIG    1       -6.082   1.598  -0.860  0.00  0.00    +0.108 A 
ATOM     24  C   LIG    1       -4.824   1.077  -1.043  0.00  0.00    +0.049 A 
ENDBRANCH   4  19
BRANCH   3  25
ATOM     25  N   LIG    1       -2.569  -0.820  -0.181  0.00  0.00    -0.326 N 
ATOM     26  H   LIG    1       -3.364  -0.849   0.456  0.00  0.00    +0.148 HD
BRANCH  25  27
ATOM     27  C   LIG    1       -1.798  -2.068  -0.238  0.00  0.00    +0.072 C 
ATOM     28  C   LIG    1       -2.355  -3.261  -0.961  0.00  0.00    +0.024 C 
ATOM     29  C   LIG    1       -1.171  -2.529  -1.522  0.00  0.00    +0.024 C 
ENDBRANCH  25  27
ENDBRANCH   3  25
TORSDOF 5