REMARK  Name = BDB000564
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.462   1.648   1.226  0.00  0.00    +0.233 C 
ATOM      2  O   LIG    1        0.151   2.826   1.088  0.00  0.00    -0.283 OA
ENDROOT
BRANCH   1   6
ATOM      3  C   LIG    1        4.268   0.177  -0.271  0.00  0.00    +0.029 A 
ATOM      4  C   LIG    1        3.355  -0.673   0.381  0.00  0.00    +0.024 A 
ATOM      5  C   LIG    1        2.124  -0.220   0.881  0.00  0.00    +0.013 A 
ATOM      6  C   LIG    1        1.759   1.116   0.735  0.00  0.00    +0.026 A 
ATOM      7  C   LIG    1        2.634   1.983   0.081  0.00  0.00    +0.013 A 
ATOM      8  C   LIG    1        3.860   1.515  -0.414  0.00  0.00    +0.024 A 
BRANCH   3  10
ATOM      9  C   LIG    1        5.995  -1.582  -0.325  0.00  0.00    +0.129 C 
ATOM     10  N   LIG    1        5.483  -0.291  -0.784  0.00  0.00    -0.336 N 
ATOM     11  C   LIG    1        6.499   0.676  -1.196  0.00  0.00    +0.129 C 
ENDBRANCH   3  10
ENDBRANCH   1   6
BRANCH   1  12
ATOM     12  C   LIG    1       -0.528   0.716   1.883  0.00  0.00    +0.233 C 
ATOM     13  O   LIG    1       -0.237   0.227   2.969  0.00  0.00    -0.283 OA
BRANCH  12  14
ATOM     14  C   LIG    1       -1.800   0.387   1.189  0.00  0.00    +0.026 A 
ATOM     15  C   LIG    1       -2.674  -0.520   1.787  0.00  0.00    +0.013 A 
ATOM     16  C   LIG    1       -3.876  -0.872   1.155  0.00  0.00    +0.024 A 
ATOM     17  C   LIG    1       -4.260  -0.330  -0.085  0.00  0.00    +0.029 A 
ATOM     18  C   LIG    1       -3.349   0.571  -0.666  0.00  0.00    +0.024 A 
ATOM     19  C   LIG    1       -2.142   0.932  -0.046  0.00  0.00    +0.013 A 
BRANCH  17  20
ATOM     20  N   LIG    1       -5.451  -0.697  -0.721  0.00  0.00    -0.336 N 
ATOM     21  C   LIG    1       -5.950   0.128  -1.822  0.00  0.00    +0.129 C 
ATOM     22  C   LIG    1       -6.475  -1.410   0.043  0.00  0.00    +0.129 C 
ENDBRANCH  17  20
ENDBRANCH  12  14
ENDBRANCH   1  12
TORSDOF 5