REMARK  Name = BDB019741
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.700  -3.167   0.240  0.00  0.00    +0.040 A 
ATOM      2  C   LIG    1        1.368  -2.281  -0.625  0.00  0.00    +0.021 A 
ATOM      3  C   LIG    1        2.198  -2.764  -1.656  0.00  0.00    +0.008 A 
ATOM      4  C   LIG    1        2.378  -4.148  -1.763  0.00  0.00    +0.163 A 
ATOM      5  F   LIG    1        3.192  -4.642  -2.708  0.00  0.00    -0.202 F 
ATOM      6  C   LIG    1        1.729  -5.024  -0.899  0.00  0.00    +0.159 A 
ATOM      7  F   LIG    1        1.914  -6.345  -1.026  0.00  0.00    -0.202 F 
ATOM      8  C   LIG    1        0.890  -4.547   0.099  0.00  0.00    +0.054 A 
ENDROOT
BRANCH   1  11
ATOM      9  N   LIG    1       -0.739  -1.446   1.197  0.00  0.00    -0.306 N 
ATOM     10  H   LIG    1       -0.663  -0.901   0.343  0.00  0.00    +0.149 HD
ATOM     11  C   LIG    1       -0.189  -2.693   1.338  0.00  0.00    +0.244 C 
ATOM     12  O   LIG    1       -0.415  -3.418   2.301  0.00  0.00    -0.270 OA
BRANCH   9  13
ATOM     13  C   LIG    1       -1.649  -0.899   2.182  0.00  0.00    +0.160 C 
BRANCH  13  16
ATOM     14  C   LIG    1       -3.380   2.470   2.257  0.00  0.00    +0.123 A 
ATOM     15  C   LIG    1       -2.944   1.206   2.646  0.00  0.00    +0.070 A 
ATOM     16  C   LIG    1       -2.126   0.481   1.788  0.00  0.00    +0.062 A 
ATOM     17  N   LIG    1       -1.739   0.959   0.575  0.00  0.00    -0.258 NA
ATOM     18  C   LIG    1       -2.179   2.183   0.223  0.00  0.00    +0.114 A 
ATOM     19  C   LIG    1       -2.992   2.971   1.021  0.00  0.00    +0.065 A 
BRANCH  14  21
ATOM     20  C   LIG    1       -4.580   4.433   2.861  0.00  0.00    +0.277 C 
ATOM     21  O   LIG    1       -4.182   3.102   3.168  0.00  0.00    -0.495 OA
ENDBRANCH  14  21
ENDBRANCH  13  16
ENDBRANCH   9  13
ENDBRANCH   1  11
BRANCH   3  22
ATOM     22  C   LIG    1        2.963  -1.850  -2.585  0.00  0.00    +0.142 C 
BRANCH  22  23
ATOM     23  N   LIG    1        2.188  -0.697  -2.998  0.00  0.00    -0.313 N 
ATOM     24  H   LIG    1        1.279  -0.938  -3.383  0.00  0.00    +0.149 HD
BRANCH  23  25
ATOM     25  C   LIG    1        2.146   0.486  -2.353  0.00  0.00    +0.176 C 
ATOM     26  N   LIG    1        3.265   0.908  -1.712  0.00  0.00    -0.316 N 
ATOM     27  H   LIG    1        4.111   0.757  -2.248  0.00  0.00    +0.149 HD
ATOM     28  C   LIG    1        3.033   2.286  -1.323  0.00  0.00    +0.127 C 
ATOM     29  C   LIG    1        1.512   2.396  -1.470  0.00  0.00    +0.163 C 
ATOM     30  N   LIG    1        1.090   1.247  -2.319  0.00  0.00    -0.255 NA
ENDBRANCH  23  25
ENDBRANCH  22  23
ENDBRANCH   3  22
TORSDOF 7