COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       6.877   2.598  -0.832  1.00  0.00           C  
HETATM    2  C   UNL     1      -3.585   0.253  -0.922  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.260  -0.660  -0.012  1.00  0.00           C  
HETATM    4  N   UNL     1      -2.041  -3.097  -0.402  1.00  0.00           N  
HETATM    5  C   UNL     1      -3.351   3.949  -1.004  1.00  0.00           C  
HETATM    6  N   UNL     1       5.639   1.837  -0.645  1.00  0.00           N  
HETATM    7  C   UNL     1      -3.362   1.680  -0.644  1.00  0.00           C  
HETATM    8  C   UNL     1       4.402   2.279  -1.293  1.00  0.00           C  
HETATM    9  C   UNL     1       5.639   0.729   0.124  1.00  0.00           C  
HETATM   10  O   UNL     1       6.637   0.422   0.747  1.00  0.00           O  
HETATM   11  C   UNL     1       4.427  -0.109   0.209  1.00  0.00           C  
HETATM   12  C   UNL     1       3.604  -0.266  -0.909  1.00  0.00           C  
HETATM   13  C   UNL     1       2.474  -1.051  -0.826  1.00  0.00           C  
HETATM   14  F   UNL     1       1.677  -1.204  -1.906  1.00  0.00           F  
HETATM   15  C   UNL     1       2.153  -1.686   0.372  1.00  0.00           C  
HETATM   16  C   UNL     1       2.971  -1.531   1.486  1.00  0.00           C  
HETATM   17  C   UNL     1       4.104  -0.752   1.407  1.00  0.00           C  
HETATM   18  N   UNL     1       1.008  -2.480   0.455  1.00  0.00           N  
HETATM   19  C   UNL     1      -0.206  -2.025   0.810  1.00  0.00           C  
HETATM   20  O   UNL     1      -0.460  -0.874   1.096  1.00  0.00           O  
HETATM   21  C   UNL     1      -1.209  -3.158   0.803  1.00  0.00           C  
HETATM   22  C   UNL     1      -0.338  -4.435   0.795  1.00  0.00           C  
HETATM   23  C   UNL     1       0.973  -3.917   0.158  1.00  0.00           C  
HETATM   24  S   UNL     1      -3.528  -2.370  -0.345  1.00  0.00           S  
HETATM   25  O   UNL     1      -4.191  -2.901   0.794  1.00  0.00           O  
HETATM   26  O   UNL     1      -4.061  -2.444  -1.660  1.00  0.00           O  
HETATM   27  S   UNL     1      -2.679   2.331   0.841  1.00  0.00           S  
HETATM   28  C   UNL     1      -2.826   3.972   0.226  1.00  0.00           C  
HETATM   29 CL   UNL     1      -2.358   5.406   1.086  1.00  0.00          Cl  
HETATM   30  C   UNL     1      -3.651   2.694  -1.488  1.00  0.00           C  
HETATM   31  H   UNL     1       6.682   3.453  -1.479  1.00  0.00           H  
HETATM   32  H   UNL     1       7.237   2.949   0.135  1.00  0.00           H  
HETATM   33  H   UNL     1       7.631   1.959  -1.291  1.00  0.00           H  
HETATM   34  H   UNL     1      -4.013  -0.053  -1.865  1.00  0.00           H  
HETATM   35  H   UNL     1      -2.832  -0.355   0.931  1.00  0.00           H  
HETATM   36  H   UNL     1      -1.722  -3.483  -1.232  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.531   4.849  -1.574  1.00  0.00           H  
HETATM   38  H   UNL     1       4.363   1.885  -2.308  1.00  0.00           H  
HETATM   39  H   UNL     1       3.545   1.912  -0.728  1.00  0.00           H  
HETATM   40  H   UNL     1       4.377   3.368  -1.324  1.00  0.00           H  
HETATM   41  H   UNL     1       3.853   0.226  -1.837  1.00  0.00           H  
HETATM   42  H   UNL     1       2.719  -2.024   2.413  1.00  0.00           H  
HETATM   43  H   UNL     1       4.741  -0.636   2.271  1.00  0.00           H  
HETATM   44  H   UNL     1      -1.831  -3.123   1.697  1.00  0.00           H  
HETATM   45  H   UNL     1      -0.167  -4.797   1.808  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.789  -5.211   0.176  1.00  0.00           H  
HETATM   47  H   UNL     1       0.962  -4.079  -0.920  1.00  0.00           H  
HETATM   48  H   UNL     1       1.832  -4.415   0.607  1.00  0.00           H  
HETATM   49  H   UNL     1      -4.081   2.533  -2.466  1.00  0.00           H  
CONECT    1    6   31   32   33                                       
CONECT    2    3    3    7   34                                       
CONECT    3   24    2    2   35                                       
CONECT    4   21   24   36                                            
CONECT    5   28   28   30   37                                       
CONECT    6    8    9    1                                            
CONECT    7   27    2   30   30                                       
CONECT    8    6   38   39   40                                       
CONECT    9   10   10    6   11                                       
CONECT   10    9    9                                                 
CONECT   11    9   17   17   12                                       
CONECT   12   11   13   13   41                                       
CONECT   13   12   12   15   14                                       
CONECT   14   13                                                      
CONECT   15   16   16   13   18                                       
CONECT   16   17   15   15   42                                       
CONECT   17   11   11   16   43                                       
CONECT   18   15   19   23                                            
CONECT   19   18   20   20   21                                       
CONECT   20   19   19                                                 
CONECT   21   19   22    4   44                                       
CONECT   22   23   21   45   46                                       
CONECT   23   18   22   47   48                                       
CONECT   24    4   25   25    3                                       
CONECT   24   26   26                                                 
CONECT   25   24   24                                                 
CONECT   26   24   24                                                 
CONECT   27    7   28                                                 
CONECT   28   27   29    5    5                                       
CONECT   29   28                                                      
CONECT   30    7    7    5   49                                       
CONECT   31    1                                                      
CONECT   32    1                                                      
CONECT   33    1                                                      
CONECT   34    2                                                      
CONECT   35    3                                                      
CONECT   36    4                                                      
CONECT   37    5                                                      
CONECT   38    8                                                      
CONECT   39    8                                                      
CONECT   40    8                                                      
CONECT   41   12                                                      
CONECT   42   16                                                      
CONECT   43   17                                                      
CONECT   44   21                                                      
CONECT   45   22                                                      
CONECT   46   22                                                      
CONECT   47   23                                                      
CONECT   48   23                                                      
CONECT   49   30                                                      
MASTER        0    0    0    0    0    0    0    0   49    0   49    0
END
