REMARK  Name = BDB001661
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.054  -0.097   0.162  0.00  0.00    +0.087 A 
ATOM      2  C   LIG    1       -1.005  -1.113  -0.157  0.00  0.00    +0.106 A 
ATOM      3  N   LIG    1       -2.260  -0.650  -0.058  0.00  0.00    -0.166 NA
ATOM      4  N   LIG    1       -2.151   0.652   0.282  0.00  0.00    -0.239 N 
ATOM      5  C   LIG    1       -0.834   1.011   0.442  0.00  0.00    +0.128 A 
ENDROOT
BRANCH   1   7
ATOM      6  O   LIG    1        1.931  -1.296   0.460  0.00  0.00    -0.265 OA
ATOM      7  C   LIG    1        1.404  -0.207   0.242  0.00  0.00    +0.284 C 
ATOM      8  N   LIG    1        2.286   0.886   0.083  0.00  0.00    -0.175 N 
ATOM      9  C   LIG    1        3.670   0.923   0.190  0.00  0.00    +0.098 A 
ATOM     10  C   LIG    1        3.985   2.247  -0.090  0.00  0.00    +0.113 A 
ATOM     11  C   LIG    1        5.324   2.666  -0.071  0.00  0.00    +0.032 A 
ATOM     12  C   LIG    1        6.316   1.726   0.233  0.00  0.00    +0.002 A 
ATOM     13  C   LIG    1        5.981   0.400   0.512  0.00  0.00    +0.002 A 
ATOM     14  N   LIG    1        2.845   2.949  -0.353  0.00  0.00    -0.129 NA
ATOM     15  C   LIG    1        4.650  -0.032   0.497  0.00  0.00    +0.030 A 
ATOM     16  N   LIG    1        1.819   2.119  -0.256  0.00  0.00    -0.057 NA
ENDBRANCH   1   7
BRANCH   2  17
ATOM     17  C   LIG    1       -0.781  -2.502  -0.559  0.00  0.00    +0.003 A 
ATOM     18  C   LIG    1       -1.521  -3.530   0.042  0.00  0.00    +0.010 A 
ATOM     19  C   LIG    1       -1.328  -4.861  -0.338  0.00  0.00    +0.001 A 
ATOM     20  C   LIG    1       -0.398  -5.174  -1.327  0.00  0.00    +0.000 A 
ATOM     21  C   LIG    1        0.334  -4.158  -1.941  0.00  0.00    +0.001 A 
ATOM     22  C   LIG    1        0.141  -2.827  -1.562  0.00  0.00    +0.010 A 
ENDBRANCH   2  17
BRANCH   4  23
ATOM     23  C   LIG    1       -3.309   1.464   0.445  0.00  0.00    +0.065 A 
ATOM     24  C   LIG    1       -3.208   2.820   0.785  0.00  0.00    +0.028 A 
ATOM     25  C   LIG    1       -4.364   3.592   0.938  0.00  0.00    +0.002 A 
ATOM     26  C   LIG    1       -5.621   3.020   0.753  0.00  0.00    +0.000 A 
ATOM     27  C   LIG    1       -5.730   1.673   0.413  0.00  0.00    +0.002 A 
ATOM     28  C   LIG    1       -4.580   0.896   0.258  0.00  0.00    +0.028 A 
ENDBRANCH   4  23
TORSDOF 3