REMARK  Name = BDB009321
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.834  -0.332  -0.833  0.00  0.00    +0.072 A 
ATOM      2  C   LIG    1        0.950   0.547  -1.905  0.00  0.00    +0.135 A 
ATOM      3  F   LIG    1        2.044   1.306  -2.058  0.00  0.00    -0.205 F 
ATOM      4  C   LIG    1       -0.074   0.651  -2.840  0.00  0.00    +0.039 A 
ATOM      5  C   LIG    1       -1.235  -0.111  -2.687  0.00  0.00    +0.007 A 
ATOM      6  C   LIG    1       -1.387  -0.971  -1.587  0.00  0.00    -0.041 A 
ATOM      7  C   LIG    1       -0.335  -1.085  -0.665  0.00  0.00    +0.020 A 
ENDROOT
BRANCH   1   9
ATOM      8  N   LIG    1        3.154  -0.867  -0.136  0.00  0.00    -0.299 N 
ATOM      9  C   LIG    1        1.878  -0.416   0.200  0.00  0.00    +0.249 C 
ATOM     10  O   LIG    1        1.547  -0.100   1.342  0.00  0.00    -0.270 OA
ATOM     11  C   LIG    1        3.572  -1.252  -1.478  0.00  0.00    +0.132 C 
BRANCH   8  12
ATOM     12  C   LIG    1        4.212  -0.712   0.868  0.00  0.00    +0.123 C 
BRANCH  12  13
ATOM     13  C   LIG    1        4.856   0.692   0.825  0.00  0.00    +0.102 C 
BRANCH  13  15
ATOM     14  C   LIG    1        5.425   0.991   3.174  0.00  0.00    +0.104 C 
ATOM     15  N   LIG    1        5.923   0.981   1.800  0.00  0.00    -0.307 NA
ATOM     16  C   LIG    1        7.072   0.093   1.665  0.00  0.00    +0.104 C 
ENDBRANCH  13  15
ENDBRANCH  12  13
ENDBRANCH   8  12
ENDBRANCH   1   9
BRANCH   6  17
ATOM     17  C   LIG    1       -2.653  -1.778  -1.402  0.00  0.00    +0.094 C 
BRANCH  17  18
ATOM     18  C   LIG    1       -3.916  -0.926  -1.398  0.00  0.00    +0.087 A 
ATOM     19  C   LIG    1       -4.291  -0.183  -0.144  0.00  0.00    +0.059 A 
ATOM     20  N   LIG    1       -3.485  -0.206   0.990  0.00  0.00    -0.342 N 
ATOM     21  H   LIG    1       -2.494  -0.321   0.789  0.00  0.00    +0.146 HD
ATOM     22  C   LIG    1       -3.729   0.733   2.082  0.00  0.00    +0.102 C 
ATOM     23  C   LIG    1       -5.232   0.863   2.311  0.00  0.00    +0.023 C 
ATOM     24  C   LIG    1       -5.957   1.253   1.016  0.00  0.00    +0.044 C 
ATOM     25  C   LIG    1       -5.449   0.494  -0.179  0.00  0.00    +0.041 A 
ATOM     26  C   LIG    1       -6.259   0.531  -1.417  0.00  0.00    +0.270 A 
ATOM     27  O   LIG    1       -7.314   1.153  -1.481  0.00  0.00    -0.266 OA
ATOM     28  N   LIG    1       -5.753  -0.158  -2.488  0.00  0.00    -0.243 N 
ATOM     29  H   LIG    1       -6.299  -0.149  -3.343  0.00  0.00    +0.192 HD
ATOM     30  N   LIG    1       -4.610  -0.896  -2.498  0.00  0.00    -0.174 NA
ENDBRANCH  17  18
ENDBRANCH   6  17
TORSDOF 6