REMARK  Name = BDB020233
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.166  -0.330   0.497  0.00  0.00    +0.061 A 
ATOM      2  C   LIG    1        1.417  -0.015  -0.098  0.00  0.00    +0.004 A 
ATOM      3  C   LIG    1        2.558  -0.678   0.413  0.00  0.00    -0.015 A 
ATOM      4  C   LIG    1        3.831  -0.406  -0.117  0.00  0.00    +0.008 A 
ATOM      5  C   LIG    1        3.995   0.510  -1.154  0.00  0.00    +0.001 A 
ATOM      6  C   LIG    1        2.887   1.163  -1.678  0.00  0.00    +0.001 A 
ATOM      7  C   LIG    1        2.413  -1.609   1.443  0.00  0.00    +0.028 A 
ATOM      8  C   LIG    1        1.151  -1.859   1.940  0.00  0.00    +0.111 A 
ATOM      9  C   LIG    1        1.616   0.904  -1.159  0.00  0.00    +0.010 A 
ATOM     10  N   LIG    1        0.038  -1.247   1.497  0.00  0.00    -0.258 NA
ENDROOT
BRANCH   1  17
ATOM     11  O   LIG    1       -5.170   0.475  -0.846  0.00  0.00    -0.275 OA
ATOM     12  C   LIG    1       -3.996   0.364  -0.506  0.00  0.00    +0.219 C 
ATOM     13  N   LIG    1       -3.105  -0.359  -1.259  0.00  0.00    -0.256 N 
ATOM     14  H   LIG    1       -3.482  -0.783  -2.095  0.00  0.00    +0.157 HD
ATOM     15  C   LIG    1       -1.731  -0.362  -1.163  0.00  0.00    +0.228 C 
ATOM     16  O   LIG    1       -1.066  -0.823  -2.089  0.00  0.00    -0.275 OA
ATOM     17  C   LIG    1       -1.131   0.333   0.054  0.00  0.00    +0.125 C 
ATOM     18  C   LIG    1       -2.169   0.394   1.188  0.00  0.00    +0.028 C 
ATOM     19  C   LIG    1       -3.432   1.081   0.694  0.00  0.00    +0.097 C 
ENDBRANCH   1  17
TORSDOF 1