REMARK  Name = BDB008854
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.595   0.195   0.556  0.00  0.00    +0.072 A 
ATOM      2  C   LIG    1        0.589   0.269   1.945  0.00  0.00    +0.135 A 
ATOM      3  F   LIG    1        1.441   1.071   2.600  0.00  0.00    -0.205 F 
ATOM      4  C   LIG    1       -0.312  -0.489   2.685  0.00  0.00    +0.039 A 
ATOM      5  C   LIG    1       -1.235  -1.310   2.030  0.00  0.00    +0.007 A 
ATOM      6  C   LIG    1       -1.276  -1.362   0.627  0.00  0.00    -0.041 A 
ATOM      7  C   LIG    1       -0.343  -0.610  -0.104  0.00  0.00    +0.020 A 
ENDROOT
BRANCH   1  12
ATOM      8  N   LIG    1        5.858   0.681   0.183  0.00  0.00    -0.300 NA
ATOM      9  C   LIG    1        4.946  -0.480   0.193  0.00  0.00    +0.103 C 
ATOM     10  C   LIG    1        3.545  -0.145   0.738  0.00  0.00    +0.123 C 
ATOM     11  N   LIG    1        2.887   0.895  -0.061  0.00  0.00    -0.295 N 
ATOM     12  C   LIG    1        1.517   1.008  -0.257  0.00  0.00    +0.249 C 
ATOM     13  O   LIG    1        1.017   1.735  -1.114  0.00  0.00    -0.270 OA
ATOM     14  C   LIG    1        3.775   1.764  -0.832  0.00  0.00    +0.123 C 
ATOM     15  C   LIG    1        5.156   1.935  -0.172  0.00  0.00    +0.103 C 
BRANCH   8  17
ATOM     16  C   LIG    1        8.195   1.348  -0.324  0.00  0.00    +0.020 C 
ATOM     17  C   LIG    1        7.034   0.414  -0.651  0.00  0.00    +0.081 C 
ENDBRANCH   8  17
ENDBRANCH   1  12
BRANCH   6  18
ATOM     18  C   LIG    1       -2.277  -2.237  -0.093  0.00  0.00    +0.092 C 
BRANCH  18  19
ATOM     19  C   LIG    1       -3.718  -2.022   0.363  0.00  0.00    +0.069 A 
ATOM     20  C   LIG    1       -4.525  -0.910  -0.231  0.00  0.00    -0.016 A 
ATOM     21  C   LIG    1       -3.929   0.021  -1.249  0.00  0.00    +0.037 C 
ATOM     22  C   LIG    1       -4.785   1.263  -1.516  0.00  0.00    +0.005 C 
ATOM     23  C   LIG    1       -6.261   0.904  -1.623  0.00  0.00    +0.005 C 
ATOM     24  C   LIG    1       -6.755   0.235  -0.339  0.00  0.00    +0.041 C 
ATOM     25  C   LIG    1       -5.797  -0.796   0.191  0.00  0.00    +0.023 A 
ATOM     26  C   LIG    1       -6.326  -1.722   1.223  0.00  0.00    +0.268 A 
ATOM     27  O   LIG    1       -7.475  -1.636   1.642  0.00  0.00    -0.266 OA
ATOM     28  N   LIG    1       -5.454  -2.674   1.677  0.00  0.00    -0.243 N 
ATOM     29  H   LIG    1       -5.799  -3.320   2.378  0.00  0.00    +0.192 HD
ATOM     30  N   LIG    1       -4.170  -2.845   1.264  0.00  0.00    -0.175 NA
ENDBRANCH  18  19
ENDBRANCH   6  18
TORSDOF 4