REMARK  Name = BDB016477
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -0.367   1.096   0.864  0.00  0.00    -0.325 N 
ATOM      2  H   LIG    1        0.208   1.933   0.849  0.00  0.00    +0.148 HD
ENDROOT
BRANCH   1   3
ATOM      3  C   LIG    1       -1.721   1.454   0.996  0.00  0.00    +0.126 A 
ATOM      4  C   LIG    1       -2.095   2.309   2.027  0.00  0.00    +0.007 A 
ATOM      5  C   LIG    1       -1.124   2.882   3.009  0.00  0.00    +0.049 C 
ATOM      6  C   LIG    1       -3.440   2.618   2.096  0.00  0.00    +0.120 A 
ATOM      7  N   LIG    1       -4.366   2.133   1.254  0.00  0.00    -0.235 NA
ATOM      8  C   LIG    1       -3.913   1.278   0.323  0.00  0.00    +0.162 A 
ATOM      9  N   LIG    1       -2.626   0.928   0.154  0.00  0.00    -0.213 NA
BRANCH   8  10
ATOM     10  C   LIG    1       -4.890   0.757  -0.637  0.00  0.00    +0.023 A 
ATOM     11  C   LIG    1       -5.367  -0.577  -0.652  0.00  0.00    -0.034 A 
ATOM     12  C   LIG    1       -6.282  -0.952  -1.664  0.00  0.00    +0.004 A 
ATOM     13  C   LIG    1       -6.738  -0.043  -2.619  0.00  0.00    +0.000 A 
ATOM     14  C   LIG    1       -6.289   1.268  -2.590  0.00  0.00    +0.001 A 
ATOM     15  C   LIG    1       -5.377   1.660  -1.611  0.00  0.00    +0.012 A 
BRANCH  11  16
ATOM     16  C   LIG    1       -4.973  -1.671   0.338  0.00  0.00    +0.014 C 
ATOM     17  C   LIG    1       -4.969  -1.262   1.813  0.00  0.00    +0.012 C 
ATOM     18  C   LIG    1       -3.660  -2.347  -0.059  0.00  0.00    +0.012 C 
ENDBRANCH  11  16
ENDBRANCH   8  10
ENDBRANCH   1   3
BRANCH   1  19
ATOM     19  C   LIG    1       -0.069   0.240  -0.278  0.00  0.00    +0.138 C 
BRANCH  19  23
ATOM     20  C   LIG    1        4.232  -0.393  -0.434  0.00  0.00    -0.016 A 
ATOM     21  C   LIG    1        3.452  -0.953   0.590  0.00  0.00    +0.009 A 
ATOM     22  C   LIG    1        2.069  -0.750   0.638  0.00  0.00    +0.006 A 
ATOM     23  C   LIG    1        1.426   0.018  -0.341  0.00  0.00    -0.030 A 
ATOM     24  C   LIG    1        2.195   0.585  -1.363  0.00  0.00    +0.006 A 
ATOM     25  C   LIG    1        3.579   0.381  -1.408  0.00  0.00    +0.009 A 
BRANCH  20  30
ATOM     26  C   LIG    1        9.886  -1.391  -0.612  0.00  0.00    +0.065 C 
ATOM     27  C   LIG    1        8.416  -1.099  -0.571  0.00  0.00    +0.038 A 
ATOM     28  N   LIG    1        7.576  -2.150  -0.447  0.00  0.00    -0.260 NA
ATOM     29  C   LIG    1        6.247  -1.882  -0.410  0.00  0.00    +0.119 A 
ATOM     30  C   LIG    1        5.685  -0.608  -0.486  0.00  0.00    +0.000 A 
ATOM     31  C   LIG    1        6.587   0.454  -0.614  0.00  0.00    +0.012 A 
ATOM     32  C   LIG    1        7.961   0.212  -0.657  0.00  0.00    +0.023 A 
ENDBRANCH  20  30
ENDBRANCH  19  23
ENDBRANCH   1  19
TORSDOF 6