COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -4.740   1.614  -0.521  1.00  0.00           O  
HETATM    2  C   UNL     1      -3.711   1.035  -0.229  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.860  -0.373   0.135  1.00  0.00           C  
HETATM    4  C   UNL     1      -4.914  -0.755   0.976  1.00  0.00           C  
HETATM    5  C   UNL     1      -5.067  -2.075   1.339  1.00  0.00           C  
HETATM    6  C   UNL     1      -4.183  -3.037   0.879  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.141  -2.679   0.047  1.00  0.00           C  
HETATM    8  C   UNL     1      -2.975  -1.353  -0.332  1.00  0.00           C  
HETATM    9  S   UNL     1      -1.652  -0.910  -1.406  1.00  0.00           S  
HETATM   10  C   UNL     1      -0.725   0.233  -0.438  1.00  0.00           C  
HETATM   11  C   UNL     1       0.594  -0.061  -0.122  1.00  0.00           C  
HETATM   12  C   UNL     1       1.342   0.825   0.640  1.00  0.00           C  
HETATM   13  C   UNL     1       0.766   2.007   1.084  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.546   2.299   0.770  1.00  0.00           C  
HETATM   15  C   UNL     1      -1.306   1.415   0.006  1.00  0.00           C  
HETATM   16  N   UNL     1      -2.621   1.753  -0.288  1.00  0.00           N  
HETATM   17  C   UNL     1      -2.819   3.137  -0.728  1.00  0.00           C  
HETATM   18  N   UNL     1       2.673   0.528   0.960  1.00  0.00           N  
HETATM   19  C   UNL     1       3.438  -0.162   0.090  1.00  0.00           C  
HETATM   20  O   UNL     1       3.005  -0.442  -1.008  1.00  0.00           O  
HETATM   21  C   UNL     1       4.830  -0.584   0.481  1.00  0.00           C  
HETATM   22  C   UNL     1       5.729   0.655   0.693  1.00  0.00           C  
HETATM   23  C   UNL     1       7.104   0.219   0.140  1.00  0.00           C  
HETATM   24  C   UNL     1       6.874  -1.231  -0.340  1.00  0.00           C  
HETATM   25  O   UNL     1       5.456  -1.314  -0.597  1.00  0.00           O  
HETATM   26  H   UNL     1      -5.608  -0.012   1.341  1.00  0.00           H  
HETATM   27  H   UNL     1      -5.883  -2.361   1.987  1.00  0.00           H  
HETATM   28  H   UNL     1      -4.309  -4.069   1.172  1.00  0.00           H  
HETATM   29  H   UNL     1      -2.453  -3.432  -0.308  1.00  0.00           H  
HETATM   30  H   UNL     1       1.038  -0.982  -0.470  1.00  0.00           H  
HETATM   31  H   UNL     1       1.344   2.699   1.677  1.00  0.00           H  
HETATM   32  H   UNL     1      -0.988   3.220   1.120  1.00  0.00           H  
HETATM   33  H   UNL     1      -3.876   3.307  -0.929  1.00  0.00           H  
HETATM   34  H   UNL     1      -2.483   3.818   0.054  1.00  0.00           H  
HETATM   35  H   UNL     1      -2.243   3.315  -1.636  1.00  0.00           H  
HETATM   36  H   UNL     1       3.045   0.819   1.807  1.00  0.00           H  
HETATM   37  H   UNL     1       4.802  -1.191   1.386  1.00  0.00           H  
HETATM   38  H   UNL     1       5.344   1.506   0.131  1.00  0.00           H  
HETATM   39  H   UNL     1       5.802   0.896   1.753  1.00  0.00           H  
HETATM   40  H   UNL     1       7.400   0.856  -0.694  1.00  0.00           H  
HETATM   41  H   UNL     1       7.858   0.246   0.927  1.00  0.00           H  
HETATM   42  H   UNL     1       7.438  -1.422  -1.253  1.00  0.00           H  
HETATM   43  H   UNL     1       7.163  -1.938   0.438  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    1    1   16    3                                       
CONECT    3    2    4    4    8                                       
CONECT    4    3    3    5   26                                       
CONECT    5    4    6    6   27                                       
CONECT    6    5    5    7   28                                       
CONECT    7    8    8    6   29                                       
CONECT    8    3    9    7    7                                       
CONECT    9    8   10                                                 
CONECT   10   15    9   11   11                                       
CONECT   11   10   10   12   30                                       
CONECT   12   13   13   11   18                                       
CONECT   13   14   12   12   31                                       
CONECT   14   15   15   13   32                                       
CONECT   15   16   14   14   10                                       
CONECT   16   17    2   15                                            
CONECT   17   16   33   34   35                                       
CONECT   18   12   19   36                                            
CONECT   19   18   20   20   21                                       
CONECT   20   19   19                                                 
CONECT   21   19   22   25   37                                       
CONECT   22   21   23   38   39                                       
CONECT   23   22   24   40   41                                       
CONECT   24   25   23   42   43                                       
CONECT   25   21   24                                                 
CONECT   26    4                                                      
CONECT   27    5                                                      
CONECT   28    6                                                      
CONECT   29    7                                                      
CONECT   30   11                                                      
CONECT   31   13                                                      
CONECT   32   14                                                      
CONECT   33   17                                                      
CONECT   34   17                                                      
CONECT   35   17                                                      
CONECT   36   18                                                      
CONECT   37   21                                                      
CONECT   38   22                                                      
CONECT   39   22                                                      
CONECT   40   23                                                      
CONECT   41   23                                                      
CONECT   42   24                                                      
CONECT   43   24                                                      
MASTER        0    0    0    0    0    0    0    0   43    0   43    0
END
