REMARK  Name = BDB027975
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.529   0.527  -0.041  0.00  0.00    +0.144 C 
ATOM      2  C   LIG    1        1.521   0.939   1.089  0.00  0.00    +0.236 C 
ATOM      3  O   LIG    1        1.204   1.419   2.175  0.00  0.00    -0.274 OA
ATOM      4  N   LIG    1        2.859   0.769   0.815  0.00  0.00    -0.255 N 
ATOM      5  H   LIG    1        3.481   1.035   1.567  0.00  0.00    +0.158 HD
ATOM      6  C   LIG    1        3.412  -0.053  -0.130  0.00  0.00    +0.219 C 
ATOM      7  O   LIG    1        4.605  -0.335  -0.110  0.00  0.00    -0.275 OA
ATOM      8  C   LIG    1        2.482  -0.547  -1.203  0.00  0.00    +0.098 C 
ATOM      9  C   LIG    1        1.079  -0.771  -0.656  0.00  0.00    +0.037 C 
ENDROOT
BRANCH   1  11
ATOM     10  C   LIG    1       -1.394   1.811   0.673  0.00  0.00    +0.106 C 
ATOM     11  N   LIG    1       -0.864   0.439   0.508  0.00  0.00    -0.287 NA
BRANCH  11  12
ATOM     12  C   LIG    1       -1.784  -0.295  -0.399  0.00  0.00    +0.108 C 
ATOM     13  C   LIG    1       -1.755  -1.815  -0.118  0.00  0.00    +0.181 C 
ATOM     14  O   LIG    1       -3.208  -1.853  -0.063  0.00  0.00    -0.377 OA
ATOM     15  C   LIG    1       -3.209  -0.421   0.194  0.00  0.00    +0.181 C 
ENDBRANCH  11  12
ENDBRANCH   1  11
TORSDOF 2