COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1 CL   UNL     1      -6.356  -3.361   0.343  1.00  0.00          Cl  
HETATM    2  C   UNL     1      -4.751  -2.718   0.183  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.958  -2.555   1.305  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.681  -2.043   1.182  1.00  0.00           C  
HETATM    5  C   UNL     1      -4.265  -2.376  -1.067  1.00  0.00           C  
HETATM    6  C   UNL     1      -2.989  -1.865  -1.197  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.193  -1.693  -0.071  1.00  0.00           C  
HETATM    8  S   UNL     1      -0.564  -1.041  -0.233  1.00  0.00           S  
HETATM    9  C   UNL     1      -0.923   0.685  -0.210  1.00  0.00           C  
HETATM   10  N   UNL     1      -2.107   1.206  -0.003  1.00  0.00           N  
HETATM   11  C   UNL     1      -2.018   2.559  -0.053  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.936   3.612   0.092  1.00  0.00           C  
HETATM   13  N   UNL     1      -4.274   3.355   0.348  1.00  0.00           N  
HETATM   14  N   UNL     1      -2.492   4.859  -0.021  1.00  0.00           N  
HETATM   15  C   UNL     1      -1.220   5.113  -0.265  1.00  0.00           C  
HETATM   16  N   UNL     1      -0.324   4.158  -0.408  1.00  0.00           N  
HETATM   17  C   UNL     1      -0.675   2.880  -0.311  1.00  0.00           C  
HETATM   18  N   UNL     1      -0.005   1.682  -0.400  1.00  0.00           N  
HETATM   19  C   UNL     1       1.427   1.506  -0.654  1.00  0.00           C  
HETATM   20  C   UNL     1       2.150   1.106   0.656  1.00  0.00           C  
HETATM   21  O   UNL     1       3.197   2.030   0.957  1.00  0.00           O  
HETATM   22  C   UNL     1       2.791   3.116   1.792  1.00  0.00           C  
HETATM   23  O   UNL     1       1.632   0.429  -1.601  1.00  0.00           O  
HETATM   24  C   UNL     1       2.854  -0.192  -1.212  1.00  0.00           C  
HETATM   25  C   UNL     1       2.723  -0.280   0.333  1.00  0.00           C  
HETATM   26  O   UNL     1       4.044  -0.510   0.832  1.00  0.00           O  
HETATM   27  C   UNL     1       3.118  -1.578  -1.765  1.00  0.00           C  
HETATM   28  O   UNL     1       4.432  -1.969  -1.301  1.00  0.00           O  
HETATM   29  P   UNL     1       4.819  -1.831   0.269  1.00  0.00           P  
HETATM   30  O   UNL     1       4.333  -3.138   1.073  1.00  0.00           O  
HETATM   31  O   UNL     1       6.282  -1.662   0.416  1.00  0.00           O  
HETATM   32  H   UNL     1      -4.338  -2.826   2.279  1.00  0.00           H  
HETATM   33  H   UNL     1      -2.063  -1.915   2.058  1.00  0.00           H  
HETATM   34  H   UNL     1      -4.885  -2.509  -1.941  1.00  0.00           H  
HETATM   35  H   UNL     1      -2.610  -1.598  -2.172  1.00  0.00           H  
HETATM   36  H   UNL     1      -4.585   2.441   0.429  1.00  0.00           H  
HETATM   37  H   UNL     1      -4.898   4.091   0.446  1.00  0.00           H  
HETATM   38  H   UNL     1      -0.901   6.141  -0.349  1.00  0.00           H  
HETATM   39  H   UNL     1       1.851   2.432  -1.044  1.00  0.00           H  
HETATM   40  H   UNL     1       1.442   1.046   1.483  1.00  0.00           H  
HETATM   41  H   UNL     1       1.998   3.678   1.298  1.00  0.00           H  
HETATM   42  H   UNL     1       2.423   2.727   2.742  1.00  0.00           H  
HETATM   43  H   UNL     1       3.642   3.773   1.974  1.00  0.00           H  
HETATM   44  H   UNL     1       3.691   0.457  -1.470  1.00  0.00           H  
HETATM   45  H   UNL     1       2.035  -1.072   0.631  1.00  0.00           H  
HETATM   46  H   UNL     1       2.368  -2.277  -1.393  1.00  0.00           H  
HETATM   47  H   UNL     1       3.097  -1.554  -2.855  1.00  0.00           H  
HETATM   48  H   UNL     1       4.728  -3.963   0.758  1.00  0.00           H  
CONECT    1    2                                                      
CONECT    2    5    1    3    3                                       
CONECT    3    2    2    4   32                                       
CONECT    4    7    7    3   33                                       
CONECT    5    6    6    2   34                                       
CONECT    6    5    5    7   35                                       
CONECT    7    6    8    4    4                                       
CONECT    8    7    9                                                 
CONECT    9   18    8   10   10                                       
CONECT   10    9    9   11                                            
CONECT   11   17   10   12   12                                       
CONECT   12   11   11   14   13                                       
CONECT   13   12   36   37                                            
CONECT   14   15   15   12                                            
CONECT   15   16   14   14   38                                       
CONECT   16   17   17   15                                            
CONECT   17   18   16   16   11                                       
CONECT   18   19   17    9                                            
CONECT   19   23   20   18   39                                       
CONECT   20   25   21   19   40                                       
CONECT   21   20   22                                                 
CONECT   22   21   41   42   43                                       
CONECT   23   24   19                                                 
CONECT   24   27   23   25   44                                       
CONECT   25   24   26   20   45                                       
CONECT   26   29   25                                                 
CONECT   27   28   24   46   47                                       
CONECT   28   27   29                                                 
CONECT   29   31   31   28   30                                       
CONECT   29   26                                                      
CONECT   30   29   48                                                 
CONECT   31   29   29                                                 
CONECT   32    3                                                      
CONECT   33    4                                                      
CONECT   34    5                                                      
CONECT   35    6                                                      
CONECT   36   13                                                      
CONECT   37   13                                                      
CONECT   38   15                                                      
CONECT   39   19                                                      
CONECT   40   20                                                      
CONECT   41   22                                                      
CONECT   42   22                                                      
CONECT   43   22                                                      
CONECT   44   24                                                      
CONECT   45   25                                                      
CONECT   46   27                                                      
CONECT   47   27                                                      
CONECT   48   30                                                      
MASTER        0    0    0    0    0    0    0    0   48    0   48    0
END
