COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -3.431   0.721   0.283  1.00  0.00           C  
HETATM    2  C   UNL     1      -1.118   0.222   0.433  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.157  -2.035   0.233  1.00  0.00           C  
HETATM    4  C   UNL     1       5.526   1.812  -0.003  1.00  0.00           C  
HETATM    5  C   UNL     1       4.621   1.392   0.950  1.00  0.00           C  
HETATM    6  C   UNL     1       3.398   0.848   0.553  1.00  0.00           C  
HETATM    7  C   UNL     1       3.108   0.735  -0.808  1.00  0.00           C  
HETATM    8  C   UNL     1       4.018   1.156  -1.750  1.00  0.00           C  
HETATM    9  C   UNL     1       5.226   1.701  -1.349  1.00  0.00           C  
HETATM   10  C   UNL     1       2.250   0.322   1.316  1.00  0.00           C  
HETATM   11  O   UNL     1       2.184   0.276   2.529  1.00  0.00           O  
HETATM   12  C   UNL     1       0.003  -0.682   0.877  1.00  0.00           C  
HETATM   13  N   UNL     1      -2.397  -0.113   0.693  1.00  0.00           N  
HETATM   14  O   UNL     1      -0.869   1.251  -0.159  1.00  0.00           O  
HETATM   15  N   UNL     1      -4.691   0.494   0.482  1.00  0.00           N  
HETATM   16  C   UNL     1      -5.541   1.395   0.025  1.00  0.00           C  
HETATM   17  C   UNL     1      -4.970   2.433  -0.590  1.00  0.00           C  
HETATM   18  S   UNL     1      -3.225   2.200  -0.550  1.00  0.00           S  
HETATM   19  C   UNL     1      -0.099  -2.157  -1.142  1.00  0.00           C  
HETATM   20  C   UNL     1      -0.247  -3.398  -1.733  1.00  0.00           C  
HETATM   21  C   UNL     1      -0.452  -4.517  -0.948  1.00  0.00           C  
HETATM   22  C   UNL     1      -0.509  -4.395   0.428  1.00  0.00           C  
HETATM   23  C   UNL     1      -0.357  -3.155   1.019  1.00  0.00           C  
HETATM   24  C   UNL     1       1.734   0.119  -0.902  1.00  0.00           C  
HETATM   25  N   UNL     1       1.287  -0.100   0.478  1.00  0.00           N  
HETATM   26  H   UNL     1       6.472   2.234   0.304  1.00  0.00           H  
HETATM   27  H   UNL     1       4.857   1.484   1.999  1.00  0.00           H  
HETATM   28  H   UNL     1       3.786   1.071  -2.802  1.00  0.00           H  
HETATM   29  H   UNL     1       5.940   2.032  -2.089  1.00  0.00           H  
HETATM   30  H   UNL     1      -0.025  -0.790   1.962  1.00  0.00           H  
HETATM   31  H   UNL     1      -2.596  -0.936   1.166  1.00  0.00           H  
HETATM   32  H   UNL     1      -6.610   1.299   0.138  1.00  0.00           H  
HETATM   33  H   UNL     1      -5.489   3.272  -1.031  1.00  0.00           H  
HETATM   34  H   UNL     1       0.061  -1.282  -1.756  1.00  0.00           H  
HETATM   35  H   UNL     1      -0.202  -3.493  -2.808  1.00  0.00           H  
HETATM   36  H   UNL     1      -0.568  -5.486  -1.410  1.00  0.00           H  
HETATM   37  H   UNL     1      -0.670  -5.269   1.041  1.00  0.00           H  
HETATM   38  H   UNL     1      -0.398  -3.060   2.094  1.00  0.00           H  
HETATM   39  H   UNL     1       1.053   0.799  -1.413  1.00  0.00           H  
HETATM   40  H   UNL     1       1.785  -0.831  -1.434  1.00  0.00           H  
CONECT    1   18   15   15   13                                       
CONECT    2   14   14   13   12                                       
CONECT    3   19   12   23   23                                       
CONECT    4    9    5    5   26                                       
CONECT    5    4    4    6   27                                       
CONECT    6    7    7   10    5                                       
CONECT    7    8   24    6    6                                       
CONECT    8    9    9    7   28                                       
CONECT    9    8    8    4   29                                       
CONECT   10   25    6   11   11                                       
CONECT   11   10   10                                                 
CONECT   12    2    3   25   30                                       
CONECT   13    1    2   31                                            
CONECT   14    2    2                                                 
CONECT   15   16    1    1                                            
CONECT   16   17   17   15   32                                       
CONECT   17   18   16   16   33                                       
CONECT   18   17    1                                                 
CONECT   19   20   20    3   34                                       
CONECT   20   19   19   21   35                                       
CONECT   21   20   22   22   36                                       
CONECT   22   21   21   23   37                                       
CONECT   23    3    3   22   38                                       
CONECT   24    7   25   39   40                                       
CONECT   25   24   12   10                                            
CONECT   26    4                                                      
CONECT   27    5                                                      
CONECT   28    8                                                      
CONECT   29    9                                                      
CONECT   30   12                                                      
CONECT   31   13                                                      
CONECT   32   16                                                      
CONECT   33   17                                                      
CONECT   34   19                                                      
CONECT   35   20                                                      
CONECT   36   21                                                      
CONECT   37   22                                                      
CONECT   38   23                                                      
CONECT   39   24                                                      
CONECT   40   24                                                      
MASTER        0    0    0    0    0    0    0    0   40    0   40    0
END
