REMARK  Name = BDB016470
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.932  -0.619   2.648  0.00  0.00    +0.066 C 
ATOM      2  C   LIG    1       -1.309  -0.151   1.276  0.00  0.00    +0.044 A 
ATOM      3  N   LIG    1       -2.606   0.128   1.050  0.00  0.00    -0.232 NA
ATOM      4  C   LIG    1       -2.929   0.510  -0.198  0.00  0.00    +0.162 A 
ATOM      5  N   LIG    1       -2.055   0.674  -1.210  0.00  0.00    -0.213 NA
ATOM      6  C   LIG    1       -0.772   0.403  -0.946  0.00  0.00    +0.123 A 
ATOM      7  C   LIG    1       -0.348  -0.030   0.293  0.00  0.00    +0.066 A 
ENDROOT
BRANCH   4   8
ATOM      8  C   LIG    1       -4.329   0.852  -0.464  0.00  0.00    +0.023 A 
ATOM      9  C   LIG    1       -5.390  -0.086  -0.511  0.00  0.00    -0.034 A 
ATOM     10  C   LIG    1       -6.702   0.393  -0.739  0.00  0.00    +0.004 A 
ATOM     11  C   LIG    1       -6.967   1.748  -0.942  0.00  0.00    +0.000 A 
ATOM     12  C   LIG    1       -5.926   2.663  -0.920  0.00  0.00    +0.001 A 
ATOM     13  C   LIG    1       -4.626   2.218  -0.684  0.00  0.00    +0.012 A 
BRANCH   9  14
ATOM     14  C   LIG    1       -5.248  -1.597  -0.334  0.00  0.00    +0.014 C 
ATOM     15  C   LIG    1       -5.243  -1.998   1.143  0.00  0.00    +0.012 C 
ATOM     16  C   LIG    1       -4.095  -2.250  -1.099  0.00  0.00    +0.012 C 
ENDBRANCH   9  14
ENDBRANCH   4   8
BRANCH   6  17
ATOM     17  N   LIG    1        0.107   0.559  -2.025  0.00  0.00    -0.325 N 
ATOM     18  H   LIG    1       -0.521   0.809  -2.789  0.00  0.00    +0.148 HD
BRANCH  17  19
ATOM     19  C   LIG    1        1.087   1.632  -1.843  0.00  0.00    +0.138 C 
BRANCH  19  20
ATOM     20  C   LIG    1        2.362   1.147  -1.192  0.00  0.00    -0.030 A 
ATOM     21  C   LIG    1        2.935   1.864  -0.134  0.00  0.00    +0.006 A 
ATOM     22  C   LIG    1        4.123   1.427   0.461  0.00  0.00    +0.009 A 
ATOM     23  C   LIG    1        4.777   0.268   0.013  0.00  0.00    -0.018 A 
ATOM     24  C   LIG    1        4.202  -0.439  -1.054  0.00  0.00    +0.009 A 
ATOM     25  C   LIG    1        3.014  -0.005  -1.652  0.00  0.00    +0.006 A 
BRANCH  23  26
ATOM     26  C   LIG    1        6.027  -0.190   0.642  0.00  0.00    -0.018 A 
ATOM     27  C   LIG    1        7.174  -0.446  -0.128  0.00  0.00    +0.008 A 
ATOM     28  C   LIG    1        8.361  -0.880   0.468  0.00  0.00    +0.001 A 
ATOM     29  C   LIG    1        8.422  -1.067   1.846  0.00  0.00    +0.000 A 
ATOM     30  C   LIG    1        7.297  -0.820   2.629  0.00  0.00    +0.001 A 
ATOM     31  C   LIG    1        6.110  -0.385   2.031  0.00  0.00    +0.008 A 
ENDBRANCH  23  26
ENDBRANCH  19  20
ENDBRANCH  17  19
ENDBRANCH   6  17
TORSDOF 6