REMARK  Name = BDB027828
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.748   0.279  -0.008  0.00  0.00    +0.076 A 
ATOM      2  N   LIG    1        1.814   1.578  -0.388  0.00  0.00    -0.245 NA
ATOM      3  C   LIG    1        0.670   2.261  -0.600  0.00  0.00    +0.091 A 
ATOM      4  C   LIG    1       -0.602   1.685  -0.457  0.00  0.00    +0.024 A 
ATOM      5  C   LIG    1       -1.744   2.476  -0.700  0.00  0.00    +0.031 A 
ATOM      6  C   LIG    1       -1.587   3.798  -1.075  0.00  0.00    +0.111 A 
ATOM      7  N   LIG    1       -0.385   4.383  -1.224  0.00  0.00    -0.261 NA
ATOM      8  C   LIG    1       -0.669   0.326  -0.072  0.00  0.00    +0.041 A 
ATOM      9  C   LIG    1        0.696   3.595  -0.981  0.00  0.00    +0.139 A 
ATOM     10  C   LIG    1        0.527  -0.370   0.144  0.00  0.00    +0.052 A 
ENDROOT
BRANCH   1  13
ATOM     11  F   LIG    1        2.244  -1.857   1.897  0.00  0.00    -0.203 F 
ATOM     12  C   LIG    1        3.245  -1.413   1.123  0.00  0.00    +0.151 A 
ATOM     13  C   LIG    1        3.051  -0.381   0.199  0.00  0.00    +0.039 A 
ATOM     14  C   LIG    1        4.181   0.025  -0.534  0.00  0.00    +0.032 A 
ATOM     15  C   LIG    1        5.401  -0.605  -0.329  0.00  0.00    +0.111 A 
ATOM     16  N   LIG    1        5.586  -1.609   0.552  0.00  0.00    -0.260 NA
ATOM     17  C   LIG    1        4.500  -1.986   1.263  0.00  0.00    +0.149 A 
ENDBRANCH   1  13
BRANCH   8  18
ATOM     18  N   LIG    1       -1.933  -0.297   0.070  0.00  0.00    -0.325 N 
ATOM     19  C   LIG    1       -2.189  -1.312  -0.981  0.00  0.00    +0.133 C 
ATOM     20  C   LIG    1       -3.619  -1.854  -0.823  0.00  0.00    +0.178 C 
ATOM     21  O   LIG    1       -3.828  -2.410   0.487  0.00  0.00    -0.377 OA
ATOM     22  C   LIG    1       -3.605  -1.408   1.495  0.00  0.00    +0.178 C 
ATOM     23  C   LIG    1       -2.172  -0.855   1.423  0.00  0.00    +0.133 C 
ENDBRANCH   8  18
TORSDOF 2