COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.292  -0.035   1.605  1.00  0.00           C  
HETATM    2  C   UNL     1       2.845  -1.327   1.288  1.00  0.00           C  
HETATM    3  C   UNL     1       2.253  -1.257   0.075  1.00  0.00           C  
HETATM    4  C   UNL     1       1.802   2.263  -1.539  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.912  -1.578  -0.567  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.753  -0.810  -1.706  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.585   0.274  -1.949  1.00  0.00           C  
HETATM    8  C   UNL     1      -2.576   0.601  -1.066  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.756  -0.161   0.093  1.00  0.00           C  
HETATM   10  C   UNL     1      -1.919  -1.260   0.347  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.381  -1.103   2.048  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.691  -0.093   1.220  1.00  0.00           C  
HETATM   13  N   UNL     1       2.711   2.908  -0.589  1.00  0.00           N  
HETATM   14  C   UNL     1       4.018   0.383   2.857  1.00  0.00           C  
HETATM   15  O   UNL     1       2.315   0.007  -0.363  1.00  0.00           O  
HETATM   16  C   UNL     1       2.945   0.768   0.556  1.00  0.00           C  
HETATM   17  C   UNL     1       3.211   2.206   0.448  1.00  0.00           C  
HETATM   18  C   UNL     1       3.078   4.316  -0.765  1.00  0.00           C  
HETATM   19  N   UNL     1      -0.072  -2.673  -0.334  1.00  0.00           N  
HETATM   20  N   UNL     1      -2.325  -1.813   1.543  1.00  0.00           N  
HETATM   21  O   UNL     1       3.884   2.766   1.294  1.00  0.00           O  
HETATM   22  O   UNL     1       1.529  -2.255  -2.165  1.00  0.00           O  
HETATM   23  O   UNL     1       2.130  -3.786  -0.284  1.00  0.00           O  
HETATM   24  S   UNL     1       1.519  -2.606  -0.789  1.00  0.00           S  
HETATM   25 CL   UNL     1      -4.957   1.073   1.441  1.00  0.00          Cl  
HETATM   26 CL   UNL     1      -3.608   1.961  -1.382  1.00  0.00          Cl  
HETATM   27  H   UNL     1       2.953  -2.212   1.898  1.00  0.00           H  
HETATM   28  H   UNL     1       2.382   1.745  -2.303  1.00  0.00           H  
HETATM   29  H   UNL     1       1.173   1.546  -1.011  1.00  0.00           H  
HETATM   30  H   UNL     1       1.173   3.019  -2.010  1.00  0.00           H  
HETATM   31  H   UNL     1       0.026  -1.056  -2.413  1.00  0.00           H  
HETATM   32  H   UNL     1      -1.449   0.865  -2.843  1.00  0.00           H  
HETATM   33  H   UNL     1      -3.890  -1.323   2.976  1.00  0.00           H  
HETATM   34  H   UNL     1       5.093   0.285   2.703  1.00  0.00           H  
HETATM   35  H   UNL     1       3.778   1.421   3.086  1.00  0.00           H  
HETATM   36  H   UNL     1       3.710  -0.253   3.686  1.00  0.00           H  
HETATM   37  H   UNL     1       2.366   4.946  -0.231  1.00  0.00           H  
HETATM   38  H   UNL     1       4.080   4.483  -0.369  1.00  0.00           H  
HETATM   39  H   UNL     1       3.060   4.565  -1.826  1.00  0.00           H  
HETATM   40  H   UNL     1      -0.421  -3.470   0.094  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.921  -2.588   1.964  1.00  0.00           H  
CONECT    1   14    2   16   16                                       
CONECT    2    1    3    3   27                                       
CONECT    3    2    2   15   24                                       
CONECT    4   13   28   29   30                                       
CONECT    5   19    6    6   10                                       
CONECT    6    5    5    7   31                                       
CONECT    7    6    8    8   32                                       
CONECT    8    7    7    9   26                                       
CONECT    9   10   10    8   12                                       
CONECT   10    5   20    9    9                                       
CONECT   11   20   12   12   33                                       
CONECT   12    9   11   11   25                                       
CONECT   13   17   18    4                                            
CONECT   14    1   34   35   36                                       
CONECT   15   16    3                                                 
CONECT   16    1    1   17   15                                       
CONECT   17   21   21   16   13                                       
CONECT   18   13   37   38   39                                       
CONECT   19   24    5   40                                            
CONECT   20   10   11   41                                            
CONECT   21   17   17                                                 
CONECT   22   24   24                                                 
CONECT   23   24   24                                                 
CONECT   24    3   22   22   23                                       
CONECT   24   23   19                                                 
CONECT   25   12                                                      
CONECT   26    8                                                      
CONECT   27    2                                                      
CONECT   28    4                                                      
CONECT   29    4                                                      
CONECT   30    4                                                      
CONECT   31    6                                                      
CONECT   32    7                                                      
CONECT   33   11                                                      
CONECT   34   14                                                      
CONECT   35   14                                                      
CONECT   36   14                                                      
CONECT   37   18                                                      
CONECT   38   18                                                      
CONECT   39   18                                                      
CONECT   40   19                                                      
CONECT   41   20                                                      
MASTER        0    0    0    0    0    0    0    0   41    0   41    0
END
