COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.723   2.349   1.491  1.00  0.00           C  
HETATM    2  C   UNL     1       2.916   1.485  -0.613  1.00  0.00           C  
HETATM    3  C   UNL     1       3.106   3.554   1.230  1.00  0.00           C  
HETATM    4  C   UNL     1       2.305   2.694  -0.871  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.871  -2.275  -0.639  1.00  0.00           C  
HETATM    6  C   UNL     1      -2.878   0.085  -1.057  1.00  0.00           C  
HETATM    7  C   UNL     1       3.635   1.307   0.569  1.00  0.00           C  
HETATM    8  C   UNL     1       3.733  -1.251   0.431  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.360  -1.173  -1.301  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.904  -2.122   0.265  1.00  0.00           C  
HETATM   11  C   UNL     1      -4.427  -0.860   0.513  1.00  0.00           C  
HETATM   12  C   UNL     1       2.396   3.730   0.050  1.00  0.00           C  
HETATM   13  C   UNL     1      -3.908   0.246  -0.150  1.00  0.00           C  
HETATM   14  C   UNL     1       4.303   0.013   0.844  1.00  0.00           C  
HETATM   15  C   UNL     1       4.509  -2.332   0.781  1.00  0.00           C  
HETATM   16  C   UNL     1       2.453  -1.368  -0.285  1.00  0.00           C  
HETATM   17  C   UNL     1      -6.500   0.123   1.142  1.00  0.00           C  
HETATM   18  C   UNL     1       1.223  -1.339  -2.301  1.00  0.00           C  
HETATM   19  C   UNL     1      -4.463  -3.324   0.982  1.00  0.00           C  
HETATM   20  C   UNL     1       4.213  -3.785   0.511  1.00  0.00           C  
HETATM   21  C   UNL     1      -7.583   0.361   2.163  1.00  0.00           C  
HETATM   22  C   UNL     1       1.074   5.031  -1.438  1.00  0.00           C  
HETATM   23  C   UNL     1      -1.237  -1.345  -2.291  1.00  0.00           C  
HETATM   24  N   UNL     1       5.441  -0.060   1.472  1.00  0.00           N  
HETATM   25  N   UNL     1       2.430  -1.348  -1.632  1.00  0.00           N  
HETATM   26  N   UNL     1       1.197  -1.445  -3.599  1.00  0.00           N  
HETATM   27  N   UNL     1      -5.474  -0.702   1.428  1.00  0.00           N  
HETATM   28  N   UNL     1       0.048  -1.218  -1.598  1.00  0.00           N  
HETATM   29  O   UNL     1       1.416  -1.484   0.340  1.00  0.00           O  
HETATM   30  O   UNL     1      -6.552   0.675   0.063  1.00  0.00           O  
HETATM   31  O   UNL     1       1.788   4.918  -0.205  1.00  0.00           O  
HETATM   32  S   UNL     1       5.884  -1.690   1.587  1.00  0.00           S  
HETATM   33 CL   UNL     1      -4.559   1.826   0.156  1.00  0.00          Cl  
HETATM   34  H   UNL     1       4.279   2.214   2.407  1.00  0.00           H  
HETATM   35  H   UNL     1       2.845   0.680  -1.329  1.00  0.00           H  
HETATM   36  H   UNL     1       3.174   4.361   1.944  1.00  0.00           H  
HETATM   37  H   UNL     1       1.757   2.836  -1.790  1.00  0.00           H  
HETATM   38  H   UNL     1      -2.463  -3.257  -0.832  1.00  0.00           H  
HETATM   39  H   UNL     1      -2.478   0.943  -1.576  1.00  0.00           H  
HETATM   40  H   UNL     1      -3.916  -3.481   1.911  1.00  0.00           H  
HETATM   41  H   UNL     1      -5.517  -3.157   1.204  1.00  0.00           H  
HETATM   42  H   UNL     1      -4.361  -4.205   0.347  1.00  0.00           H  
HETATM   43  H   UNL     1       4.638  -4.070  -0.451  1.00  0.00           H  
HETATM   44  H   UNL     1       4.653  -4.398   1.298  1.00  0.00           H  
HETATM   45  H   UNL     1       3.134  -3.939   0.492  1.00  0.00           H  
HETATM   46  H   UNL     1      -7.367  -0.215   3.063  1.00  0.00           H  
HETATM   47  H   UNL     1      -7.623   1.421   2.411  1.00  0.00           H  
HETATM   48  H   UNL     1      -8.544   0.047   1.753  1.00  0.00           H  
HETATM   49  H   UNL     1       1.759   4.868  -2.270  1.00  0.00           H  
HETATM   50  H   UNL     1       0.281   4.284  -1.468  1.00  0.00           H  
HETATM   51  H   UNL     1       0.638   6.027  -1.515  1.00  0.00           H  
HETATM   52  H   UNL     1      -1.306  -2.331  -2.751  1.00  0.00           H  
HETATM   53  H   UNL     1      -1.311  -0.578  -3.062  1.00  0.00           H  
HETATM   54  H   UNL     1       3.261  -1.339  -2.132  1.00  0.00           H  
HETATM   55  H   UNL     1       2.026  -1.457  -4.101  1.00  0.00           H  
HETATM   56  H   UNL     1      -5.461  -1.187   2.269  1.00  0.00           H  
HETATM   57  H   UNL     1       0.069  -1.049  -0.643  1.00  0.00           H  
CONECT    1    3    7    7   34                                       
CONECT    2    4    4    7   35                                       
CONECT    3   12   12    1   36                                       
CONECT    4   12    2    2   37                                       
CONECT    5   10   10    9   38                                       
CONECT    6   13    9    9   39                                       
CONECT    7    1    1    2   14                                       
CONECT    8   14   15   15   16                                       
CONECT    9    6    6    5   23                                       
CONECT   10   11   19    5    5                                       
CONECT   11   27   13   13   10                                       
CONECT   12   31    3    3    4                                       
CONECT   13   33   11   11    6                                       
CONECT   14    7   24   24    8                                       
CONECT   15   32    8    8   20                                       
CONECT   16    8   29   29   25                                       
CONECT   17   21   30   30   27                                       
CONECT   18   28   25   26   26                                       
CONECT   19   10   40   41   42                                       
CONECT   20   15   43   44   45                                       
CONECT   21   17   46   47   48                                       
CONECT   22   31   49   50   51                                       
CONECT   23    9   28   52   53                                       
CONECT   24   14   14   32                                            
CONECT   25   16   18   54                                            
CONECT   26   18   18   55                                            
CONECT   27   17   11   56                                            
CONECT   28   23   18   57                                            
CONECT   29   16   16                                                 
CONECT   30   17   17                                                 
CONECT   31   22   12                                                 
CONECT   32   24   15                                                 
CONECT   33   13                                                      
CONECT   34    1                                                      
CONECT   35    2                                                      
CONECT   36    3                                                      
CONECT   37    4                                                      
CONECT   38    5                                                      
CONECT   39    6                                                      
CONECT   40   19                                                      
CONECT   41   19                                                      
CONECT   42   19                                                      
CONECT   43   20                                                      
CONECT   44   20                                                      
CONECT   45   20                                                      
CONECT   46   21                                                      
CONECT   47   21                                                      
CONECT   48   21                                                      
CONECT   49   22                                                      
CONECT   50   22                                                      
CONECT   51   22                                                      
CONECT   52   23                                                      
CONECT   53   23                                                      
CONECT   54   25                                                      
CONECT   55   26                                                      
CONECT   56   27                                                      
CONECT   57   28                                                      
MASTER        0    0    0    0    0    0    0    0   57    0   57    0
END
