COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       7.757   0.283   0.897  1.00  0.00           C  
HETATM    2  C   UNL     1       1.840   0.816  -1.862  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.138   2.978  -0.545  1.00  0.00           C  
HETATM    4  C   UNL     1      -0.990  -2.884   0.708  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.018  -1.678   0.012  1.00  0.00           C  
HETATM    6  C   UNL     1      -2.963   0.831  -1.820  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.649   1.722  -0.817  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.788   1.284  -0.169  1.00  0.00           C  
HETATM    9  C   UNL     1      -5.418   2.100   0.752  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.907   3.358   1.025  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.762   3.794   0.379  1.00  0.00           C  
HETATM   12  O   UNL     1       8.049   0.751   1.980  1.00  0.00           O  
HETATM   13  O   UNL     1       8.723  -0.191   0.086  1.00  0.00           O  
HETATM   14  C   UNL     1       6.346   0.227   0.475  1.00  0.00           C  
HETATM   15  C   UNL     1       6.010  -0.317  -0.770  1.00  0.00           C  
HETATM   16  C   UNL     1       4.702  -0.373  -1.158  1.00  0.00           C  
HETATM   17  C   UNL     1       3.700   0.113  -0.314  1.00  0.00           C  
HETATM   18  C   UNL     1       4.035   0.657   0.929  1.00  0.00           C  
HETATM   19  C   UNL     1       5.343   0.713   1.319  1.00  0.00           C  
HETATM   20  C   UNL     1       2.284   0.052  -0.736  1.00  0.00           C  
HETATM   21  N   UNL     1       1.487   1.421  -2.756  1.00  0.00           N  
HETATM   22  C   UNL     1       1.393  -0.740  -0.045  1.00  0.00           C  
HETATM   23  C   UNL     1       0.010  -0.684  -0.352  1.00  0.00           C  
HETATM   24  C   UNL     1      -2.155  -3.600   0.879  1.00  0.00           C  
HETATM   25  C   UNL     1      -3.352  -3.124   0.361  1.00  0.00           C  
HETATM   26 CL   UNL     1      -4.809  -4.042   0.579  1.00  0.00          Cl  
HETATM   27  C   UNL     1      -3.393  -1.931  -0.330  1.00  0.00           C  
HETATM   28  C   UNL     1      -2.228  -1.191  -0.508  1.00  0.00           C  
HETATM   29  N   UNL     1      -1.962   0.007  -1.137  1.00  0.00           N  
HETATM   30  C   UNL     1      -0.642   0.309  -1.050  1.00  0.00           C  
HETATM   31  F   UNL     1      -5.522   4.156   1.924  1.00  0.00           F  
HETATM   32  H   UNL     1      -2.247   3.320  -1.052  1.00  0.00           H  
HETATM   33  H   UNL     1      -0.060  -3.259   1.107  1.00  0.00           H  
HETATM   34  H   UNL     1      -3.701   0.186  -2.297  1.00  0.00           H  
HETATM   35  H   UNL     1      -2.474   1.445  -2.576  1.00  0.00           H  
HETATM   36  H   UNL     1      -5.187   0.303  -0.382  1.00  0.00           H  
HETATM   37  H   UNL     1      -6.308   1.757   1.258  1.00  0.00           H  
HETATM   38  H   UNL     1      -3.363   4.774   0.591  1.00  0.00           H  
HETATM   39  H   UNL     1       9.633  -0.136   0.408  1.00  0.00           H  
HETATM   40  H   UNL     1       6.784  -0.692  -1.423  1.00  0.00           H  
HETATM   41  H   UNL     1       4.442  -0.793  -2.119  1.00  0.00           H  
HETATM   42  H   UNL     1       3.261   1.033   1.581  1.00  0.00           H  
HETATM   43  H   UNL     1       5.601   1.129   2.282  1.00  0.00           H  
HETATM   44  H   UNL     1       1.748  -1.402   0.730  1.00  0.00           H  
HETATM   45  H   UNL     1      -2.137  -4.536   1.418  1.00  0.00           H  
HETATM   46  H   UNL     1      -4.329  -1.570  -0.729  1.00  0.00           H  
HETATM   47  H   UNL     1      -0.174   1.187  -1.470  1.00  0.00           H  
CONECT    1   14   12   12   13                                       
CONECT    2   20   21   21   21                                       
CONECT    3   11   11    7   32                                       
CONECT    4   24   24    5   33                                       
CONECT    5   28   28    4   23                                       
CONECT    6    7   29   34   35                                       
CONECT    7    3    6    8    8                                       
CONECT    8    7    7    9   36                                       
CONECT    9   10   10    8   37                                       
CONECT   10   11   31    9    9                                       
CONECT   11    3    3   10   38                                       
CONECT   12    1    1                                                 
CONECT   13    1   39                                                 
CONECT   14   15   15   19    1                                       
CONECT   15   16   14   14   40                                       
CONECT   16   17   17   15   41                                       
CONECT   17   20   16   16   18                                       
CONECT   18   17   19   19   42                                       
CONECT   19   18   18   14   43                                       
CONECT   20   22   22    2   17                                       
CONECT   21    2    2    2                                            
CONECT   22   23   20   20   44                                       
CONECT   23    5   30   30   22                                       
CONECT   24   25    4    4   45                                       
CONECT   25   26   27   27   24                                       
CONECT   26   25                                                      
CONECT   27   25   25   28   46                                       
CONECT   28   27   29    5    5                                       
CONECT   29   28    6   30                                            
CONECT   30   29   23   23   47                                       
CONECT   31   10                                                      
CONECT   32    3                                                      
CONECT   33    4                                                      
CONECT   34    6                                                      
CONECT   35    6                                                      
CONECT   36    8                                                      
CONECT   37    9                                                      
CONECT   38   11                                                      
CONECT   39   13                                                      
CONECT   40   15                                                      
CONECT   41   16                                                      
CONECT   42   18                                                      
CONECT   43   19                                                      
CONECT   44   22                                                      
CONECT   45   24                                                      
CONECT   46   27                                                      
CONECT   47   30                                                      
MASTER        0    0    0    0    0    0    0    0   47    0   47    0
END
