REMARK  Name = BDB044820
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.856   2.408   1.051  0.00  0.00    +0.008 C 
ATOM      2  C   LIG    1       -1.050   1.539   0.044  0.00  0.00    -0.073 C 
ATOM      3  C   LIG    1        0.079   0.707  -0.492  0.00  0.00    +0.019 C 
ATOM      4  C   LIG    1        1.444   1.409  -0.715  0.00  0.00    +0.014 C 
ATOM      5  C   LIG    1        2.153   0.136  -0.167  0.00  0.00    -0.031 C 
ATOM      6  C   LIG    1        2.662  -0.772  -1.289  0.00  0.00    +0.011 C 
ATOM      7  C   LIG    1        3.266   0.436   0.836  0.00  0.00    +0.011 C 
ATOM      8  C   LIG    1        0.786  -0.246   0.523  0.00  0.00    +0.002 C 
ATOM      9  C   LIG    1        0.409  -1.730   0.566  0.00  0.00    +0.009 C 
ATOM     10  C   LIG    1       -1.056  -1.936   0.965  0.00  0.00    +0.027 C 
ATOM     11  C   LIG    1       -1.944  -2.027  -0.246  0.00  0.00    -0.031 C 
ATOM     12  C   LIG    1       -2.841  -1.126  -0.673  0.00  0.00    -0.031 C 
ATOM     13  C   LIG    1       -3.196   0.181  -0.021  0.00  0.00    +0.031 C 
ATOM     14  C   LIG    1       -2.414   1.373  -0.590  0.00  0.00    +0.034 C 
ENDROOT
TORSDOF 0