REMARK  Name = BDB036847
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.626  -0.730   1.497  0.00  0.00    +0.133 C 
ATOM      2  N   LIG    1       -0.973   0.057   0.316  0.00  0.00    -0.289 N 
ATOM      3  C   LIG    1       -0.032   0.557  -0.584  0.00  0.00    +0.247 C 
ATOM      4  O   LIG    1       -0.329   0.958  -1.707  0.00  0.00    -0.270 OA
ENDROOT
BRANCH   2   5
ATOM      5  C   LIG    1       -2.395   0.207  -0.041  0.00  0.00    +0.163 C 
ATOM      6  C   LIG    1       -3.331   0.500   1.147  0.00  0.00    +0.240 C 
ATOM      7  O   LIG    1       -2.962   0.990   2.213  0.00  0.00    -0.273 OA
ATOM      8  N   LIG    1       -4.665   0.230   0.940  0.00  0.00    -0.255 N 
ATOM      9  H   LIG    1       -5.279   0.428   1.718  0.00  0.00    +0.158 HD
ATOM     10  C   LIG    1       -5.232  -0.456  -0.105  0.00  0.00    +0.219 C 
ATOM     11  O   LIG    1       -6.423  -0.751  -0.093  0.00  0.00    -0.275 OA
ATOM     12  C   LIG    1       -4.329  -0.781  -1.269  0.00  0.00    +0.098 C 
ATOM     13  C   LIG    1       -2.899  -1.017  -0.810  0.00  0.00    +0.041 C 
ENDBRANCH   2   5
BRANCH   3  14
ATOM     14  C   LIG    1        1.391   0.623  -0.181  0.00  0.00    +0.040 A 
ATOM     15  C   LIG    1        2.358   0.081  -1.034  0.00  0.00    +0.059 A 
ATOM     16  C   LIG    1        3.713   0.148  -0.698  0.00  0.00    +0.131 A 
ATOM     17  C   LIG    1        4.090   0.776   0.492  0.00  0.00    +0.046 A 
ATOM     18  C   LIG    1        3.123   1.340   1.332  0.00  0.00    +0.004 A 
ATOM     19  C   LIG    1        1.773   1.272   0.995  0.00  0.00    +0.013 A 
BRANCH  16  20
ATOM     20  O   LIG    1        4.549  -0.430  -1.611  0.00  0.00    -0.406 OA
BRANCH  20  21
ATOM     21  C   LIG    1        5.941  -0.394  -1.351  0.00  0.00    +0.575 C 
ATOM     22  F   LIG    1        6.239  -1.047  -0.206  0.00  0.00    -0.133 F 
ATOM     23  F   LIG    1        6.392   0.876  -1.275  0.00  0.00    -0.133 F 
ATOM     24  F   LIG    1        6.588  -1.010  -2.365  0.00  0.00    -0.133 F 
ENDBRANCH  20  21
ENDBRANCH  16  20
ENDBRANCH   3  14
TORSDOF 4