REMARK  Name = BDB001713
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.675   0.319   0.064  0.00  0.00    +0.132 A 
ATOM      2  C   LIG    1       -0.264   0.260   0.028  0.00  0.00    +0.074 A 
ATOM      3  C   LIG    1        0.578   1.485   0.116  0.00  0.00    +0.191 C 
ATOM      4  C   LIG    1        2.045   1.321   0.070  0.00  0.00    +0.058 C 
ATOM      5  C   LIG    1        2.650   0.135  -0.046  0.00  0.00    +0.000 C 
ATOM      6  C   LIG    1        1.842  -1.103  -0.135  0.00  0.00    +0.190 C 
ATOM      7  O   LIG    1        2.381  -2.199  -0.241  0.00  0.00    -0.287 OA
ATOM      8  C   LIG    1        4.138  -0.025  -0.092  0.00  0.00    +0.048 C 
ATOM      9  O   LIG    1        0.137   2.621   0.223  0.00  0.00    -0.287 OA
ATOM     10  C   LIG    1        0.369  -0.984  -0.093  0.00  0.00    +0.036 A 
ATOM     11  C   LIG    1       -0.387  -2.162  -0.178  0.00  0.00    +0.012 A 
ATOM     12  C   LIG    1       -1.775  -2.103  -0.143  0.00  0.00    +0.004 A 
ATOM     13  C   LIG    1       -2.415  -0.870  -0.022  0.00  0.00    +0.046 A 
ENDROOT
BRANCH   1  15
ATOM     14  C   LIG    1       -3.672   1.642   0.221  0.00  0.00    +0.277 C 
ATOM     15  O   LIG    1       -2.256   1.552   0.183  0.00  0.00    -0.494 OA
ENDBRANCH   1  15
TORSDOF 1