REMARK  Name = BDB027950
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.606  -0.575  -1.519  0.00  0.00    +0.028 A 
ATOM      2  C   LIG    1        0.394  -0.722  -0.838  0.00  0.00    +0.027 A 
ATOM      3  C   LIG    1       -0.846  -0.531  -1.482  0.00  0.00    -0.032 A 
ATOM      4  C   LIG    1       -0.866  -0.160  -2.830  0.00  0.00    +0.005 A 
ATOM      5  C   LIG    1        0.329   0.030  -3.516  0.00  0.00    +0.002 A 
ATOM      6  C   LIG    1        1.547  -0.165  -2.861  0.00  0.00    +0.023 A 
ENDROOT
BRANCH   1   7
ATOM      7  N   LIG    1        2.871  -0.687  -0.930  0.00  0.00    -0.333 N 
ATOM      8  H   LIG    1        3.541  -1.012  -1.625  0.00  0.00    +0.147 HD
BRANCH   7  15
ATOM      9  O   LIG    1        5.697   1.290   2.197  0.00  0.00    -0.275 OA
ATOM     10  C   LIG    1        4.922   0.577   1.564  0.00  0.00    +0.219 C 
ATOM     11  N   LIG    1        3.568   0.678   1.739  0.00  0.00    -0.255 N 
ATOM     12  H   LIG    1        3.304   1.290   2.499  0.00  0.00    +0.158 HD
ATOM     13  C   LIG    1        2.699  -0.366   1.536  0.00  0.00    +0.239 C 
ATOM     14  O   LIG    1        1.744  -0.542   2.290  0.00  0.00    -0.273 OA
ATOM     15  C   LIG    1        3.053  -1.321   0.387  0.00  0.00    +0.158 C 
ATOM     16  C   LIG    1        4.529  -1.693   0.565  0.00  0.00    +0.041 C 
ATOM     17  C   LIG    1        5.409  -0.448   0.567  0.00  0.00    +0.098 C 
ENDBRANCH   7  15
ENDBRANCH   1   7
BRANCH   3  18
ATOM     18  C   LIG    1       -2.140  -0.725  -0.717  0.00  0.00    +0.119 C 
BRANCH  18  19
ATOM     19  N   LIG    1       -2.295   0.204   0.412  0.00  0.00    -0.298 NA
ATOM     20  C   LIG    1       -2.455   1.608   0.005  0.00  0.00    +0.085 C 
ATOM     21  C   LIG    1       -3.820   1.927  -0.611  0.00  0.00    +0.015 C 
ATOM     22  C   LIG    1       -4.957   1.492   0.308  0.00  0.00    +0.002 C 
ATOM     23  C   LIG    1       -4.782   0.042   0.745  0.00  0.00    +0.015 C 
ATOM     24  C   LIG    1       -3.382  -0.203   1.312  0.00  0.00    +0.085 C 
ENDBRANCH  18  19
ENDBRANCH   3  18
TORSDOF 4