REMARK  Name = BDB034445
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.809   0.169  -1.398  0.00  0.00    +0.082 C 
ENDROOT
BRANCH   1   2
ATOM      2  N   LIG    1        2.189   1.342  -0.614  0.00  0.00    -0.312 NA
ATOM      3  H   LIG    1        2.083   1.173   0.386  0.00  0.00    +0.122 HD
BRANCH   2   4
ATOM      4  C   LIG    1        3.550   1.806  -0.890  0.00  0.00    +0.122 C 
BRANCH   4  11
ATOM      5  F   LIG    1        7.598  -1.667   0.983  0.00  0.00    -0.199 F 
ATOM      6  C   LIG    1        6.639  -0.843   0.539  0.00  0.00    +0.199 A 
ATOM      7  C   LIG    1        5.826  -0.173   1.441  0.00  0.00    +0.197 A 
ATOM      8  F   LIG    1        5.995  -0.350   2.758  0.00  0.00    -0.199 F 
ATOM      9  C   LIG    1        4.829   0.682   0.977  0.00  0.00    +0.169 A 
ATOM     10  F   LIG    1        4.046   1.317   1.861  0.00  0.00    -0.202 F 
ATOM     11  C   LIG    1        4.626   0.882  -0.393  0.00  0.00    +0.043 A 
ATOM     12  C   LIG    1        5.458   0.197  -1.284  0.00  0.00    +0.169 A 
ATOM     13  F   LIG    1        5.295   0.360  -2.605  0.00  0.00    -0.202 F 
ATOM     14  C   LIG    1        6.457  -0.658  -0.824  0.00  0.00    +0.197 A 
ATOM     15  F   LIG    1        7.239  -1.305  -1.699  0.00  0.00    -0.199 F 
ENDBRANCH   4  11
ENDBRANCH   2   4
ENDBRANCH   1   2
BRANCH   1  16
ATOM     16  C   LIG    1        0.323  -0.172  -1.230  0.00  0.00    +0.030 C 
BRANCH  16  17
ATOM     17  C   LIG    1       -0.034  -0.635   0.185  0.00  0.00    +0.082 C 
BRANCH  17  18
ATOM     18  N   LIG    1       -1.399  -1.167   0.309  0.00  0.00    -0.313 NA
ATOM     19  H   LIG    1       -1.478  -1.574   1.242  0.00  0.00    +0.122 HD
BRANCH  18  20
ATOM     20  C   LIG    1       -2.445  -0.141   0.135  0.00  0.00    +0.061 C 
ATOM     21  C   LIG    1       -3.512  -0.272   1.231  0.00  0.00    +0.041 C 
ATOM     22  C   LIG    1       -4.845   0.490   1.012  0.00  0.00    +0.099 C 
ATOM     23  C   LIG    1       -5.566  -0.852   0.768  0.00  0.00    +0.039 C 
ATOM     24 CL   LIG    1       -5.425   1.497   2.354  0.00  0.00    -0.101 Cl
ATOM     25  N   LIG    1       -4.803   1.313  -0.198  0.00  0.00    -0.298 NA
ATOM     26  H   LIG    1       -4.362   2.216  -0.026  0.00  0.00    +0.124 HD
ATOM     27  C   LIG    1       -4.250   0.707  -1.406  0.00  0.00    +0.084 C 
ATOM     28  C   LIG    1       -4.347  -1.579   1.366  0.00  0.00    +0.011 C 
ATOM     29  C   LIG    1       -3.123  -0.307  -1.222  0.00  0.00    +0.034 C 
ENDBRANCH  18  20
ENDBRANCH  17  18
ENDBRANCH  16  17
ENDBRANCH   1  16
TORSDOF 7