REMARK  Name = BDB008832
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -2.196  -0.934   0.806  0.00  0.00    +0.072 A 
ATOM      2  C   LIG    1       -2.105  -1.609   2.034  0.00  0.00    +0.145 A 
ATOM      3  F   LIG    1       -2.853  -2.686   2.307  0.00  0.00    -0.204 F 
ATOM      4  C   LIG    1       -1.311  -1.130   3.078  0.00  0.00    +0.040 A 
ATOM      5  C   LIG    1       -0.588   0.049   2.929  0.00  0.00    +0.007 A 
ATOM      6  C   LIG    1       -0.660   0.760   1.728  0.00  0.00    -0.040 A 
ATOM      7  C   LIG    1       -1.482   0.273   0.691  0.00  0.00    +0.030 A 
ENDROOT
BRANCH   1  10
ATOM      8  O   LIG    1       -3.181  -3.735   0.141  0.00  0.00    -0.275 OA
ATOM      9  C   LIG    1       -3.466  -2.711  -0.459  0.00  0.00    +0.220 C 
ATOM     10  N   LIG    1       -2.983  -1.405  -0.286  0.00  0.00    -0.269 N 
ATOM     11  C   LIG    1       -3.487  -0.527  -1.319  0.00  0.00    +0.114 C 
ATOM     12  C   LIG    1       -4.038  -1.458  -2.380  0.00  0.00    +0.029 C 
ATOM     13  C   LIG    1       -4.458  -2.683  -1.596  0.00  0.00    +0.098 C 
ENDBRANCH   1  10
BRANCH   6  14
ATOM     14  C   LIG    1        0.105   2.055   1.566  0.00  0.00    +0.092 C 
BRANCH  14  15
ATOM     15  C   LIG    1        0.909   2.132   0.270  0.00  0.00    +0.069 A 
ATOM     16  C   LIG    1        2.165   1.330   0.127  0.00  0.00    -0.016 A 
ATOM     17  C   LIG    1        2.680   0.485   1.258  0.00  0.00    +0.037 C 
ATOM     18  C   LIG    1        4.126   0.019   1.057  0.00  0.00    +0.005 C 
ATOM     19  C   LIG    1        4.351  -0.467  -0.369  0.00  0.00    +0.005 C 
ATOM     20  C   LIG    1        4.051   0.641  -1.380  0.00  0.00    +0.041 C 
ATOM     21  C   LIG    1        2.800   1.410  -1.056  0.00  0.00    +0.023 A 
ATOM     22  C   LIG    1        2.268   2.287  -2.129  0.00  0.00    +0.268 A 
ATOM     23  O   LIG    1        2.830   2.399  -3.214  0.00  0.00    -0.266 OA
ATOM     24  N   LIG    1        1.117   2.965  -1.833  0.00  0.00    -0.243 N 
ATOM     25  H   LIG    1        0.741   3.574  -2.552  0.00  0.00    +0.192 HD
ATOM     26  N   LIG    1        0.427   2.898  -0.664  0.00  0.00    -0.175 NA
ENDBRANCH  14  15
ENDBRANCH   6  14
TORSDOF 3