REMARK  Name = BDB042483
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -2.187  -1.439  -2.060  0.00  0.00    +0.054 C 
ENDROOT
BRANCH   1   9
ATOM      2  C   LIG    1       -5.167  -0.960   2.330  0.00  0.00    +0.044 C 
ATOM      3  C   LIG    1       -5.381   0.240   1.446  0.00  0.00    -0.042 A 
ATOM      4  C   LIG    1       -4.721   0.392   0.204  0.00  0.00    -0.005 A 
ATOM      5  C   LIG    1       -4.970   1.542  -0.574  0.00  0.00    +0.082 A 
ATOM      6  C   LIG    1       -4.276   1.698  -1.877  0.00  0.00    +0.259 A 
ATOM      7  N   LIG    1       -3.415   0.684  -2.235  0.00  0.00    -0.326 N 
ATOM      8  H   LIG    1       -2.955   0.819  -3.128  0.00  0.00    +0.169 HD
ATOM      9  C   LIG    1       -3.158  -0.438  -1.487  0.00  0.00    +0.020 A 
ATOM     10  O   LIG    1       -4.440   2.662  -2.614  0.00  0.00    -0.267 OA
ATOM     11  C   LIG    1       -5.856   2.518  -0.123  0.00  0.00    +0.136 A 
ATOM     12  F   LIG    1       -6.114   3.622  -0.838  0.00  0.00    -0.205 F 
ATOM     13  C   LIG    1       -6.506   2.370   1.097  0.00  0.00    +0.039 A 
ATOM     14  C   LIG    1       -3.777  -0.615  -0.309  0.00  0.00    +0.030 A 
ATOM     15  C   LIG    1       -6.271   1.239   1.877  0.00  0.00    +0.007 A 
ENDBRANCH   1   9
BRANCH   1  16
ATOM     16  C   LIG    1       -0.745  -0.927  -2.188  0.00  0.00    +0.021 C 
BRANCH  16  17
ATOM     17  C   LIG    1       -0.120  -0.555  -0.834  0.00  0.00    +0.085 C 
BRANCH  17  18
ATOM     18  N   LIG    1        1.264  -0.071  -0.960  0.00  0.00    -0.299 NA
ATOM     19  C   LIG    1        1.762   0.486   0.323  0.00  0.00    +0.103 C 
ATOM     20  C   LIG    1        2.666  -0.468   1.133  0.00  0.00    +0.120 C 
ATOM     21  N   LIG    1        3.864  -0.866   0.364  0.00  0.00    -0.327 N 
ATOM     22  C   LIG    1        3.666  -0.890  -1.108  0.00  0.00    +0.120 C 
ATOM     23  C   LIG    1        2.180  -1.120  -1.470  0.00  0.00    +0.103 C 
BRANCH  21  24
ATOM     24  C   LIG    1        5.119  -0.361   0.726  0.00  0.00    +0.030 A 
ATOM     25  C   LIG    1        6.270  -1.098   0.397  0.00  0.00    +0.024 A 
ATOM     26  C   LIG    1        7.551  -0.644   0.726  0.00  0.00    +0.022 A 
ATOM     27  C   LIG    1        7.701   0.566   1.391  0.00  0.00    +0.041 A 
ATOM     28 CL   LIG    1        9.272   1.134   1.798  0.00  0.00    -0.084 Cl
ATOM     29  C   LIG    1        6.582   1.321   1.726  0.00  0.00    +0.022 A 
ATOM     30  C   LIG    1        5.302   0.858   1.395  0.00  0.00    +0.024 A 
ENDBRANCH  21  24
ENDBRANCH  17  18
ENDBRANCH  16  17
ENDBRANCH   1  16
TORSDOF 5