REMARK  Name = BDB016465
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.534  -0.486  -2.411  0.00  0.00    +0.010 A 
ATOM      2  C   LIG    1       -0.983   0.053  -1.254  0.00  0.00    +0.126 A 
ATOM      3  N   LIG    1       -1.735   0.724  -0.364  0.00  0.00    -0.213 NA
ATOM      4  C   LIG    1       -3.057   0.821  -0.599  0.00  0.00    +0.162 A 
ATOM      5  N   LIG    1       -3.681   0.320  -1.677  0.00  0.00    -0.235 NA
ATOM      6  C   LIG    1       -2.899  -0.322  -2.558  0.00  0.00    +0.120 A 
ENDROOT
BRANCH   4   7
ATOM      7  C   LIG    1       -3.858   1.583   0.375  0.00  0.00    +0.023 A 
ATOM      8  C   LIG    1       -5.061   1.105   0.960  0.00  0.00    -0.034 A 
ATOM      9  C   LIG    1       -5.776   1.952   1.835  0.00  0.00    +0.004 A 
ATOM     10  C   LIG    1       -5.308   3.224   2.164  0.00  0.00    +0.000 A 
ATOM     11  C   LIG    1       -4.116   3.682   1.623  0.00  0.00    +0.001 A 
ATOM     12  C   LIG    1       -3.404   2.871   0.741  0.00  0.00    +0.012 A 
BRANCH   8  13
ATOM     13  C   LIG    1       -5.603  -0.295   0.674  0.00  0.00    +0.014 C 
ATOM     14  C   LIG    1       -5.965  -1.067   1.950  0.00  0.00    +0.012 C 
ATOM     15  C   LIG    1       -6.804  -0.229  -0.273  0.00  0.00    +0.012 C 
ENDBRANCH   8  13
ENDBRANCH   4   7
BRANCH   1  17
ATOM     16  C   LIG    1       -0.676  -2.713  -3.181  0.00  0.00    +0.009 C 
ATOM     17  C   LIG    1       -0.744  -1.218  -3.458  0.00  0.00    +0.037 C 
ENDBRANCH   1  17
BRANCH   2  18
ATOM     18  N   LIG    1        0.400  -0.057  -1.032  0.00  0.00    -0.325 N 
ATOM     19  H   LIG    1        0.687  -1.027  -1.120  0.00  0.00    +0.148 HD
BRANCH  18  20
ATOM     20  C   LIG    1        0.868   0.511   0.227  0.00  0.00    +0.138 C 
BRANCH  20  21
ATOM     21  C   LIG    1        2.353   0.253   0.358  0.00  0.00    -0.030 A 
ATOM     22  C   LIG    1        3.255   0.824  -0.549  0.00  0.00    +0.006 A 
ATOM     23  C   LIG    1        4.628   0.586  -0.434  0.00  0.00    +0.009 A 
ATOM     24  C   LIG    1        5.140  -0.228   0.588  0.00  0.00    -0.018 A 
ATOM     25  C   LIG    1        4.228  -0.796   1.493  0.00  0.00    +0.009 A 
ATOM     26  C   LIG    1        2.853  -0.561   1.381  0.00  0.00    +0.006 A 
BRANCH  24  27
ATOM     27  C   LIG    1        6.586  -0.478   0.709  0.00  0.00    -0.018 A 
ATOM     28  C   LIG    1        7.092  -1.786   0.784  0.00  0.00    +0.008 A 
ATOM     29  C   LIG    1        8.465  -2.023   0.898  0.00  0.00    +0.001 A 
ATOM     30  C   LIG    1        9.356  -0.954   0.939  0.00  0.00    +0.000 A 
ATOM     31  C   LIG    1        8.876   0.351   0.867  0.00  0.00    +0.001 A 
ATOM     32  C   LIG    1        7.503   0.586   0.752  0.00  0.00    +0.008 A 
ENDBRANCH  24  27
ENDBRANCH  20  21
ENDBRANCH  18  20
ENDBRANCH   2  18
TORSDOF 7