COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       2.751   3.387   0.182  1.00  0.00           N  
HETATM    2  C   UNL     1       0.244   1.502  -1.168  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.947   0.545  -1.191  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.264   0.123   0.234  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.488  -0.612   2.051  1.00  0.00           C  
HETATM    6  C   UNL     1       1.126   0.422   0.857  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.736  -0.222  -0.074  1.00  0.00           C  
HETATM    8  C   UNL     1      -5.730  -1.264  -0.874  1.00  0.00           C  
HETATM    9  C   UNL     1      -4.074   0.903  -0.823  1.00  0.00           C  
HETATM   10  C   UNL     1       3.394  -0.190  -0.823  1.00  0.00           C  
HETATM   11  C   UNL     1       2.680  -1.325  -1.159  1.00  0.00           C  
HETATM   12  C   UNL     1       4.642  -2.657  -0.830  1.00  0.00           C  
HETATM   13  C   UNL     1       4.732  -0.288  -0.491  1.00  0.00           C  
HETATM   14  C   UNL     1       3.478   2.114   0.090  1.00  0.00           C  
HETATM   15  C   UNL     1       2.715   1.155  -0.826  1.00  0.00           C  
HETATM   16  N   UNL     1       1.340   1.009  -0.342  1.00  0.00           N  
HETATM   17  C   UNL     1      -2.497  -0.239   0.744  1.00  0.00           C  
HETATM   18  S   UNL     1      -0.912  -0.514   2.700  1.00  0.00           S  
HETATM   19  C   UNL     1      -0.263   0.059   1.181  1.00  0.00           C  
HETATM   20  O   UNL     1       2.039   0.204   1.631  1.00  0.00           O  
HETATM   21  C   UNL     1      -4.584  -1.332  -0.100  1.00  0.00           C  
HETATM   22  C   UNL     1      -5.991  -0.115  -1.597  1.00  0.00           C  
HETATM   23  N   UNL     1      -5.174   0.919  -1.548  1.00  0.00           N  
HETATM   24  C   UNL     1       3.304  -2.559  -1.161  1.00  0.00           C  
HETATM   25  C   UNL     1       5.355  -1.522  -0.490  1.00  0.00           C  
HETATM   26  H   UNL     1       1.804   3.241   0.498  1.00  0.00           H  
HETATM   27  H   UNL     1       3.236   4.038   0.782  1.00  0.00           H  
HETATM   28  H   UNL     1       0.605   1.640  -2.187  1.00  0.00           H  
HETATM   29  H   UNL     1      -0.085   2.465  -0.777  1.00  0.00           H  
HETATM   30  H   UNL     1      -1.811   1.048  -1.624  1.00  0.00           H  
HETATM   31  H   UNL     1      -0.698  -0.333  -1.787  1.00  0.00           H  
HETATM   32  H   UNL     1      -3.360  -0.926   2.605  1.00  0.00           H  
HETATM   33  H   UNL     1      -6.407  -2.104  -0.921  1.00  0.00           H  
HETATM   34  H   UNL     1      -3.430   1.769  -0.808  1.00  0.00           H  
HETATM   35  H   UNL     1       1.634  -1.248  -1.418  1.00  0.00           H  
HETATM   36  H   UNL     1       5.129  -3.621  -0.828  1.00  0.00           H  
HETATM   37  H   UNL     1       5.291   0.599  -0.234  1.00  0.00           H  
HETATM   38  H   UNL     1       4.473   2.292  -0.319  1.00  0.00           H  
HETATM   39  H   UNL     1       3.568   1.674   1.083  1.00  0.00           H  
HETATM   40  H   UNL     1       2.703   1.554  -1.840  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.351  -2.220   0.468  1.00  0.00           H  
HETATM   42  H   UNL     1      -6.878  -0.063  -2.211  1.00  0.00           H  
HETATM   43  H   UNL     1       2.747  -3.445  -1.427  1.00  0.00           H  
HETATM   44  H   UNL     1       6.400  -1.599  -0.230  1.00  0.00           H  
CONECT    1   14   26   27                                            
CONECT    2   16    3   28   29                                       
CONECT    3    2    4   30   31                                       
CONECT    4   19   19   17    3                                       
CONECT    5   18   17   17   32                                       
CONECT    6   20   20   16   19                                       
CONECT    7   17   21   21    9                                       
CONECT    8   21   22   22   33                                       
CONECT    9    7   23   23   34                                       
CONECT   10   11   11   13   15                                       
CONECT   11   24   10   10   35                                       
CONECT   12   24   24   25   36                                       
CONECT   13   25   25   10   37                                       
CONECT   14   15    1   38   39                                       
CONECT   15   10   16   14   40                                       
CONECT   16   15    6    2                                            
CONECT   17    5    5    4    7                                       
CONECT   18   19    5                                                 
CONECT   19   18    6    4    4                                       
CONECT   20    6    6                                                 
CONECT   21    7    7    8   41                                       
CONECT   22    8    8   23   42                                       
CONECT   23    9    9   22                                            
CONECT   24   12   12   11   43                                       
CONECT   25   12   13   13   44                                       
CONECT   26    1                                                      
CONECT   27    1                                                      
CONECT   28    2                                                      
CONECT   29    2                                                      
CONECT   30    3                                                      
CONECT   31    3                                                      
CONECT   32    5                                                      
CONECT   33    8                                                      
CONECT   34    9                                                      
CONECT   35   11                                                      
CONECT   36   12                                                      
CONECT   37   13                                                      
CONECT   38   14                                                      
CONECT   39   14                                                      
CONECT   40   15                                                      
CONECT   41   21                                                      
CONECT   42   22                                                      
CONECT   43   24                                                      
CONECT   44   25                                                      
MASTER        0    0    0    0    0    0    0    0   44    0   44    0
END
