REMARK  Name = BDB009335
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.644  -2.021  -1.544  0.00  0.00    +0.072 A 
ATOM      2  C   LIG    1       -0.337  -3.190  -0.860  0.00  0.00    +0.135 A 
ATOM      3  F   LIG    1       -1.301  -4.028  -0.454  0.00  0.00    -0.205 F 
ATOM      4  C   LIG    1        0.986  -3.488  -0.549  0.00  0.00    +0.039 A 
ATOM      5  C   LIG    1        2.006  -2.612  -0.931  0.00  0.00    +0.007 A 
ATOM      6  C   LIG    1        1.709  -1.437  -1.639  0.00  0.00    -0.041 A 
ATOM      7  C   LIG    1        0.371  -1.146  -1.947  0.00  0.00    +0.020 A 
ENDROOT
BRANCH   1   9
ATOM      8  O   LIG    1       -2.592  -2.398  -2.731  0.00  0.00    -0.270 OA
ATOM      9  C   LIG    1       -2.043  -1.713  -1.872  0.00  0.00    +0.249 C 
ATOM     10  N   LIG    1       -2.654  -0.634  -1.229  0.00  0.00    -0.295 N 
ATOM     11  C   LIG    1       -4.075  -0.427  -1.509  0.00  0.00    +0.123 C 
ATOM     12  C   LIG    1       -4.559   0.991  -1.149  0.00  0.00    +0.103 C 
ATOM     13  N   LIG    1       -4.183   1.456   0.202  0.00  0.00    -0.297 NA
ATOM     14  C   LIG    1       -2.721   1.305   0.358  0.00  0.00    +0.103 C 
ATOM     15  C   LIG    1       -2.181  -0.106   0.059  0.00  0.00    +0.123 C 
BRANCH  13  16
ATOM     16  C   LIG    1       -4.915   0.771   1.288  0.00  0.00    +0.112 C 
BRANCH  16  17
ATOM     17  C   LIG    1       -6.400   1.164   1.399  0.00  0.00    +0.171 C 
BRANCH  17  18
ATOM     18  O   LIG    1       -6.536   2.513   1.835  0.00  0.00    -0.394 OA
ATOM     19  H   LIG    1       -7.469   2.759   1.721  0.00  0.00    +0.209 HD
ENDBRANCH  17  18
ENDBRANCH  16  17
ENDBRANCH  13  16
ENDBRANCH   1   9
BRANCH   6  20
ATOM     20  C   LIG    1        2.800  -0.464  -2.020  0.00  0.00    +0.094 C 
BRANCH  20  21
ATOM     21  C   LIG    1        2.982   0.617  -0.961  0.00  0.00    +0.087 A 
ATOM     22  C   LIG    1        3.992   0.414   0.138  0.00  0.00    +0.059 A 
ATOM     23  N   LIG    1        4.858  -0.677   0.157  0.00  0.00    -0.342 N 
ATOM     24  H   LIG    1        5.110  -1.025  -0.765  0.00  0.00    +0.146 HD
ATOM     25  C   LIG    1        5.974  -0.713   1.099  0.00  0.00    +0.102 C 
ATOM     26  C   LIG    1        5.519  -0.167   2.449  0.00  0.00    +0.023 C 
ATOM     27  C   LIG    1        4.915   1.234   2.298  0.00  0.00    +0.044 C 
ATOM     28  C   LIG    1        3.997   1.339   1.111  0.00  0.00    +0.041 A 
ATOM     29  C   LIG    1        3.108   2.519   1.034  0.00  0.00    +0.270 A 
ATOM     30  O   LIG    1        3.107   3.385   1.903  0.00  0.00    -0.266 OA
ATOM     31  N   LIG    1        2.306   2.596  -0.073  0.00  0.00    -0.243 N 
ATOM     32  H   LIG    1        1.689   3.398  -0.143  0.00  0.00    +0.192 HD
ATOM     33  N   LIG    1        2.204   1.657  -1.052  0.00  0.00    -0.174 NA
ENDBRANCH  20  21
ENDBRANCH   6  20
TORSDOF 6