REMARK  Name = BDB009311
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.449  -0.195   0.460  0.00  0.00    +0.072 A 
ATOM      2  C   LIG    1        0.449   1.045  -0.181  0.00  0.00    +0.135 A 
ATOM      3  F   LIG    1        1.468   1.906  -0.031  0.00  0.00    -0.205 F 
ATOM      4  C   LIG    1       -0.611   1.428  -1.001  0.00  0.00    +0.039 A 
ATOM      5  C   LIG    1       -1.691   0.566  -1.193  0.00  0.00    +0.007 A 
ATOM      6  C   LIG    1       -1.714  -0.688  -0.568  0.00  0.00    -0.041 A 
ATOM      7  C   LIG    1       -0.641  -1.056   0.262  0.00  0.00    +0.020 A 
ENDROOT
BRANCH   1   9
ATOM      8  O   LIG    1        1.585  -1.807   1.748  0.00  0.00    -0.270 OA
ATOM      9  C   LIG    1        1.562  -0.652   1.339  0.00  0.00    +0.247 C 
ATOM     10  N   LIG    1        2.538   0.266   1.654  0.00  0.00    -0.303 N 
ATOM     11  H   LIG    1        2.453   1.221   1.329  0.00  0.00    +0.150 HD
BRANCH  10  12
ATOM     12  C   LIG    1        3.643  -0.074   2.530  0.00  0.00    +0.200 C 
BRANCH  12  13
ATOM     13  C   LIG    1        4.820  -0.869   1.927  0.00  0.00    +0.233 C 
ATOM     14  N   LIG    1        5.301  -0.542   0.661  0.00  0.00    -0.300 N 
ATOM     15  C   LIG    1        6.417  -1.305   0.111  0.00  0.00    +0.108 C 
ATOM     16  C   LIG    1        7.602  -0.389  -0.186  0.00  0.00    +0.019 C 
ATOM     17  C   LIG    1        7.196   0.906  -0.898  0.00  0.00    +0.003 C 
ATOM     18  C   LIG    1        5.734   0.900  -1.331  0.00  0.00    +0.019 C 
ATOM     19  C   LIG    1        4.812   0.565  -0.156  0.00  0.00    +0.108 C 
ATOM     20  O   LIG    1        5.414  -1.685   2.641  0.00  0.00    -0.274 OA
ENDBRANCH  12  13
ENDBRANCH  10  12
ENDBRANCH   1   9
BRANCH   6  21
ATOM     21  C   LIG    1       -2.891  -1.620  -0.749  0.00  0.00    +0.094 C 
BRANCH  21  22
ATOM     22  C   LIG    1       -4.048  -1.267   0.177  0.00  0.00    +0.087 A 
ATOM     23  C   LIG    1       -5.158  -0.380  -0.326  0.00  0.00    +0.059 A 
ATOM     24  N   LIG    1       -5.233   0.032  -1.655  0.00  0.00    -0.342 N 
ATOM     25  H   LIG    1       -4.849  -0.638  -2.317  0.00  0.00    +0.146 HD
ATOM     26  C   LIG    1       -6.444   0.682  -2.153  0.00  0.00    +0.102 C 
ATOM     27  C   LIG    1       -6.974   1.648  -1.099  0.00  0.00    +0.023 C 
ATOM     28  C   LIG    1       -7.196   0.932   0.239  0.00  0.00    +0.044 C 
ATOM     29  C   LIG    1       -6.064   0.004   0.587  0.00  0.00    +0.041 A 
ATOM     30  C   LIG    1       -5.997  -0.502   1.976  0.00  0.00    +0.270 A 
ATOM     31  O   LIG    1       -6.821  -0.173   2.823  0.00  0.00    -0.266 OA
ATOM     32  N   LIG    1       -4.978  -1.374   2.248  0.00  0.00    -0.243 N 
ATOM     33  H   LIG    1       -4.906  -1.725   3.197  0.00  0.00    +0.192 HD
ATOM     34  N   LIG    1       -3.988  -1.738   1.389  0.00  0.00    -0.174 NA
ENDBRANCH  21  22
ENDBRANCH   6  21
TORSDOF 5