REMARK  Name = BDB053232
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.876   0.729  -0.211  0.00  0.00    +0.041 A 
ATOM      2  C   LIG    1        1.971  -0.170  -0.285  0.00  0.00    +0.010 A 
ATOM      3  C   LIG    1        3.284   0.358  -0.316  0.00  0.00    +0.048 A 
ATOM      4  C   LIG    1        4.454  -0.558  -0.394  0.00  0.00    +0.257 A 
ATOM      5  N   LIG    1        4.173  -1.903  -0.433  0.00  0.00    -0.329 N 
ATOM      6  H   LIG    1        4.981  -2.513  -0.486  0.00  0.00    +0.168 HD
ATOM      7  C   LIG    1        2.913  -2.426  -0.404  0.00  0.00    +0.086 A 
ATOM      8  O   LIG    1        5.607  -0.143  -0.423  0.00  0.00    -0.267 OA
ATOM      9  C   LIG    1        3.519   1.735  -0.274  0.00  0.00    +0.014 A 
ATOM     10  C   LIG    1        2.444   2.608  -0.201  0.00  0.00    +0.003 A 
ATOM     11  C   LIG    1        1.832  -1.642  -0.334  0.00  0.00    +0.028 A 
ATOM     12  C   LIG    1        1.139   2.109  -0.170  0.00  0.00    +0.024 A 
ENDROOT
BRANCH   1  14
ATOM     13  C   LIG    1       -1.645   0.935  -0.107  0.00  0.00    +0.223 C 
ATOM     14  N   LIG    1       -0.453   0.227  -0.178  0.00  0.00    -0.285 N 
ATOM     15  H   LIG    1       -0.547  -0.774  -0.212  0.00  0.00    +0.155 HD
ATOM     16  O   LIG    1       -1.744   2.157  -0.059  0.00  0.00    -0.275 OA
BRANCH  13  18
ATOM     17  C   LIG    1       -4.165   0.913  -0.012  0.00  0.00    +0.020 C 
ATOM     18  C   LIG    1       -2.904   0.032  -0.092  0.00  0.00    +0.039 C 
ATOM     19  C   LIG    1       -2.879  -0.892   1.135  0.00  0.00    +0.020 C 
ATOM     20  C   LIG    1       -2.974  -0.800  -1.382  0.00  0.00    +0.020 C 
ENDBRANCH  13  18
ENDBRANCH   1  14
TORSDOF 2