REMARK  Name = BDB008934
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.332  -0.567   0.015  0.00  0.00    +0.037 A 
ATOM      2  C   LIG    1       -0.864  -0.883   0.673  0.00  0.00    +0.017 A 
ATOM      3  C   LIG    1       -1.800  -1.744   0.082  0.00  0.00    -0.041 A 
ATOM      4  C   LIG    1       -1.510  -2.300  -1.171  0.00  0.00    +0.004 A 
ATOM      5  C   LIG    1       -0.325  -1.979  -1.836  0.00  0.00    +0.001 A 
ATOM      6  C   LIG    1        0.594  -1.108  -1.249  0.00  0.00    +0.013 A 
ENDROOT
BRANCH   1   8
ATOM      7  O   LIG    1        0.854   1.195   1.484  0.00  0.00    -0.270 OA
ATOM      8  C   LIG    1        1.277   0.373   0.680  0.00  0.00    +0.244 C 
ATOM      9  N   LIG    1        2.612   0.221   0.360  0.00  0.00    -0.310 N 
ATOM     10  H   LIG    1        2.883  -0.669  -0.035  0.00  0.00    +0.149 HD
BRANCH   9  11
ATOM     11  C   LIG    1        3.632   0.969   1.082  0.00  0.00    +0.123 C 
BRANCH  11  12
ATOM     12  C   LIG    1        4.964   1.085   0.304  0.00  0.00    +0.071 C 
ATOM     13  N   LIG    1        5.880   1.999   1.018  0.00  0.00    -0.312 NA
ATOM     14  H   LIG    1        6.265   2.666   0.348  0.00  0.00    +0.122 HD
ATOM     15  C   LIG    1        6.986   1.303   1.671  0.00  0.00    +0.081 C 
ATOM     16  C   LIG    1        7.859   0.565   0.658  0.00  0.00    +0.015 C 
ATOM     17  C   LIG    1        7.040  -0.181  -0.396  0.00  0.00    +0.003 C 
ATOM     18  C   LIG    1        5.577  -0.302   0.017  0.00  0.00    +0.020 C 
ENDBRANCH  11  12
ENDBRANCH   9  11
ENDBRANCH   1   8
BRANCH   3  19
ATOM     19  C   LIG    1       -3.087  -2.081   0.799  0.00  0.00    +0.092 C 
BRANCH  19  20
ATOM     20  C   LIG    1       -4.335  -1.778  -0.025  0.00  0.00    +0.069 A 
ATOM     21  C   LIG    1       -4.790  -0.361  -0.193  0.00  0.00    -0.016 A 
ATOM     22  C   LIG    1       -4.066   0.773   0.478  0.00  0.00    +0.037 C 
ATOM     23  C   LIG    1       -4.861   2.082   0.481  0.00  0.00    +0.005 C 
ATOM     24  C   LIG    1       -5.499   2.339  -0.878  0.00  0.00    +0.005 C 
ATOM     25  C   LIG    1       -6.441   1.197  -1.266  0.00  0.00    +0.041 C 
ATOM     26  C   LIG    1       -5.873  -0.163  -0.965  0.00  0.00    +0.023 A 
ATOM     27  C   LIG    1       -6.574  -1.320  -1.577  0.00  0.00    +0.268 A 
ATOM     28  O   LIG    1       -7.573  -1.177  -2.275  0.00  0.00    -0.266 OA
ATOM     29  N   LIG    1       -6.041  -2.552  -1.311  0.00  0.00    -0.243 N 
ATOM     30  H   LIG    1       -6.506  -3.355  -1.719  0.00  0.00    +0.192 HD
ATOM     31  N   LIG    1       -4.937  -2.800  -0.558  0.00  0.00    -0.175 NA
ENDBRANCH  19  20
ENDBRANCH   3  19
TORSDOF 5