REMARK  Name = BDB064447
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.959  -2.643  -2.043  0.00  0.00    +0.217 A 
ATOM      2  N   LIG    1        2.025  -2.813  -1.255  0.00  0.00    -0.214 NA
ATOM      3  C   LIG    1        2.246  -1.903  -0.304  0.00  0.00    +0.078 A 
ATOM      4  C   LIG    1        1.418  -0.797  -0.107  0.00  0.00    +0.041 A 
ATOM      5  C   LIG    1        1.705   0.115   0.945  0.00  0.00    +0.022 A 
ATOM      6  C   LIG    1        2.813  -0.051   1.788  0.00  0.00    -0.017 A 
ATOM      7  C   LIG    1        3.633  -1.160   1.559  0.00  0.00    +0.010 A 
ATOM      8  C   LIG    1        0.337  -0.695  -0.998  0.00  0.00    +0.132 A 
ATOM      9  C   LIG    1        3.343  -2.065   0.530  0.00  0.00    +0.029 A 
ATOM     10  N   LIG    1        0.107  -1.621  -1.944  0.00  0.00    -0.199 NA
ENDROOT
BRANCH   6  11
ATOM     11  C   LIG    1        3.097   0.901   2.873  0.00  0.00    -0.018 A 
ATOM     12  C   LIG    1        2.113   1.238   3.818  0.00  0.00    +0.008 A 
ATOM     13  C   LIG    1        2.382   2.143   4.848  0.00  0.00    +0.001 A 
ATOM     14  C   LIG    1        3.642   2.728   4.950  0.00  0.00    +0.000 A 
ATOM     15  C   LIG    1        4.631   2.409   4.024  0.00  0.00    +0.001 A 
ATOM     16  C   LIG    1        4.361   1.503   2.995  0.00  0.00    +0.008 A 
ENDBRANCH   6  11
BRANCH   1  18
ATOM     17  C   LIG    1        0.992  -4.928  -2.707  0.00  0.00    +0.128 C 
ATOM     18  N   LIG    1        0.672  -3.559  -3.047  0.00  0.00    -0.316 N 
ATOM     19  H   LIG    1       -0.297  -3.391  -3.294  0.00  0.00    +0.149 HD
ENDBRANCH   1  18
BRANCH   8  20
ATOM     20  N   LIG    1       -0.548   0.405  -0.883  0.00  0.00    -0.328 N 
ATOM     21  H   LIG    1        0.005   1.256  -0.937  0.00  0.00    +0.147 HD
BRANCH  20  22
ATOM     22  C   LIG    1       -1.641   0.420  -1.859  0.00  0.00    +0.106 C 
BRANCH  22  23
ATOM     23  C   LIG    1       -2.550   1.641  -1.600  0.00  0.00    +0.008 C 
ATOM     24  C   LIG    1       -3.242   1.572  -0.231  0.00  0.00    +0.020 C 
ATOM     25  C   LIG    1       -4.273   0.440  -0.162  0.00  0.00    +0.081 C 
ATOM     26  N   LIG    1       -4.976   0.198  -1.425  0.00  0.00    -0.316 NA
ATOM     27  H   LIG    1       -5.918  -0.140  -1.232  0.00  0.00    +0.122 HD
ATOM     28  C   LIG    1       -5.019   1.381  -2.272  0.00  0.00    +0.081 C 
ATOM     29  C   LIG    1       -3.609   1.780  -2.716  0.00  0.00    +0.020 C 
ENDBRANCH  22  23
ENDBRANCH  20  22
ENDBRANCH   8  20
TORSDOF 5