REMARK  Name = BDB016993
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        4.894  -2.291  -0.863  0.00  0.00    +0.112 A 
ATOM      2  N   LIG    1        3.609  -2.144  -1.241  0.00  0.00    -0.253 NA
ATOM      3  C   LIG    1        2.944  -1.040  -0.819  0.00  0.00    +0.091 A 
ATOM      4  C   LIG    1        3.548  -0.076  -0.018  0.00  0.00    +0.041 A 
ATOM      5  C   LIG    1        4.883  -0.249   0.367  0.00  0.00    +0.026 A 
ATOM      6  C   LIG    1        5.567  -1.384  -0.068  0.00  0.00    +0.031 A 
ENDROOT
BRANCH   5   7
ATOM      7  C   LIG    1        5.540   0.743   1.204  0.00  0.00    +0.204 A 
ATOM      8  N   LIG    1        6.820   0.675   1.614  0.00  0.00    -0.133 NA
ATOM      9  N   LIG    1        6.899   1.804   2.332  0.00  0.00    -0.176 N 
ATOM     10  H   LIG    1        7.754   2.088   2.804  0.00  0.00    +0.214 HD
ATOM     11  N   LIG    1        5.785   2.541   2.396  0.00  0.00    -0.049 NA
ATOM     12  N   LIG    1        4.901   1.869   1.673  0.00  0.00    -0.108 NA
ENDBRANCH   5   7
BRANCH   3  13
ATOM     13  C   LIG    1        1.552  -0.919  -1.253  0.00  0.00    +0.107 A 
ATOM     14  N   LIG    1        1.000  -1.651  -2.288  0.00  0.00    -0.234 NA
ATOM     15  C   LIG    1       -0.253  -1.269  -2.372  0.00  0.00    +0.200 A 
ATOM     16  N   LIG    1       -0.545  -0.328  -1.430  0.00  0.00    -0.335 N 
ATOM     17  C   LIG    1        0.593  -0.084  -0.711  0.00  0.00    +0.117 A 
BRANCH  16  18
ATOM     18  C   LIG    1       -1.836   0.303  -1.235  0.00  0.00    +0.138 C 
BRANCH  18  19
ATOM     19  C   LIG    1       -2.716  -0.495  -0.265  0.00  0.00    +0.106 C 
BRANCH  19  20
ATOM     20  N   LIG    1       -4.053   0.090  -0.104  0.00  0.00    -0.301 NA
ATOM     21  C   LIG    1       -4.054   1.369   0.612  0.00  0.00    +0.084 C 
ATOM     22  C   LIG    1       -5.508   1.544   1.025  0.00  0.00    +0.017 C 
ATOM     23  C   LIG    1       -6.100   0.140   1.021  0.00  0.00    +0.017 C 
ATOM     24  C   LIG    1       -4.935  -0.776   0.684  0.00  0.00    +0.084 C 
ENDBRANCH  19  20
ENDBRANCH  18  19
ENDBRANCH  16  18
ENDBRANCH   3  13
TORSDOF 5