COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -2.675  -0.979   0.393  1.00  0.00           N  
HETATM    2  C   UNL     1      -8.056   0.375  -0.544  1.00  0.00           C  
HETATM    3  O   UNL     1       4.439  -2.437   0.163  1.00  0.00           O  
HETATM    4  C   UNL     1      -6.628  -0.035  -0.295  1.00  0.00           C  
HETATM    5  C   UNL     1       1.769  -0.012  -0.329  1.00  0.00           C  
HETATM    6  C   UNL     1       2.427  -1.221  -0.199  1.00  0.00           C  
HETATM    7  C   UNL     1       3.793  -1.247   0.034  1.00  0.00           C  
HETATM    8  C   UNL     1       3.647  -3.621   0.047  1.00  0.00           C  
HETATM    9  C   UNL     1       4.502  -0.056   0.136  1.00  0.00           C  
HETATM   10  C   UNL     1       6.697  -0.108  -0.780  1.00  0.00           C  
HETATM   11  C   UNL     1       3.838   1.157   0.004  1.00  0.00           C  
HETATM   12  C   UNL     1       3.782   3.534  -0.059  1.00  0.00           C  
HETATM   13  C   UNL     1       2.472   1.175  -0.234  1.00  0.00           C  
HETATM   14  C   UNL     1      -6.296  -1.380  -0.217  1.00  0.00           C  
HETATM   15  C   UNL     1      -5.010  -1.768   0.007  1.00  0.00           C  
HETATM   16  C   UNL     1      -5.653   0.926  -0.144  1.00  0.00           C  
HETATM   17  C   UNL     1      -4.333   0.548   0.087  1.00  0.00           C  
HETATM   18  C   UNL     1      -3.991  -0.807   0.166  1.00  0.00           C  
HETATM   19  C   UNL     1      -1.946   0.067   0.501  1.00  0.00           C  
HETATM   20  C   UNL     1      -0.460   0.043   0.754  1.00  0.00           C  
HETATM   21  C   UNL     1       0.284   0.013  -0.582  1.00  0.00           C  
HETATM   22  O   UNL     1       5.844  -0.078   0.365  1.00  0.00           O  
HETATM   23  O   UNL     1       4.528   2.325   0.098  1.00  0.00           O  
HETATM   24  S   UNL     1      -2.866   1.493   0.322  1.00  0.00           S  
HETATM   25  H   UNL     1      -8.573   0.489   0.408  1.00  0.00           H  
HETATM   26  H   UNL     1      -8.074   1.322  -1.083  1.00  0.00           H  
HETATM   27  H   UNL     1      -8.555  -0.391  -1.139  1.00  0.00           H  
HETATM   28  H   UNL     1       1.875  -2.146  -0.279  1.00  0.00           H  
HETATM   29  H   UNL     1       2.877  -3.620   0.819  1.00  0.00           H  
HETATM   30  H   UNL     1       3.176  -3.648  -0.936  1.00  0.00           H  
HETATM   31  H   UNL     1       4.283  -4.497   0.169  1.00  0.00           H  
HETATM   32  H   UNL     1       7.738  -0.124  -0.458  1.00  0.00           H  
HETATM   33  H   UNL     1       6.486  -1.002  -1.367  1.00  0.00           H  
HETATM   34  H   UNL     1       6.519   0.777  -1.390  1.00  0.00           H  
HETATM   35  H   UNL     1       4.451   4.389   0.038  1.00  0.00           H  
HETATM   36  H   UNL     1       3.316   3.548  -1.044  1.00  0.00           H  
HETATM   37  H   UNL     1       3.011   3.587   0.709  1.00  0.00           H  
HETATM   38  H   UNL     1       1.955   2.118  -0.337  1.00  0.00           H  
HETATM   39  H   UNL     1      -7.066  -2.127  -0.337  1.00  0.00           H  
HETATM   40  H   UNL     1      -4.769  -2.820   0.065  1.00  0.00           H  
HETATM   41  H   UNL     1      -5.912   1.973  -0.204  1.00  0.00           H  
HETATM   42  H   UNL     1      -0.172   0.934   1.311  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.205  -0.845   1.332  1.00  0.00           H  
HETATM   44  H   UNL     1       0.028   0.901  -1.161  1.00  0.00           H  
HETATM   45  H   UNL     1      -0.004  -0.879  -1.139  1.00  0.00           H  
CONECT    1   19   19   18                                            
CONECT    2    4   25   26   27                                       
CONECT    3    7    8                                                 
CONECT    4   16    2   14   14                                       
CONECT    5   13   21    6    6                                       
CONECT    6    5    5    7   28                                       
CONECT    7    9    9    6    3                                       
CONECT    8    3   29   30   31                                       
CONECT    9   11   22    7    7                                       
CONECT   10   22   32   33   34                                       
CONECT   11   23   13   13    9                                       
CONECT   12   23   35   36   37                                       
CONECT   13   11   11    5   38                                       
CONECT   14    4    4   15   39                                       
CONECT   15   18   18   14   40                                       
CONECT   16   17   17    4   41                                       
CONECT   17   24   16   16   18                                       
CONECT   18   17    1   15   15                                       
CONECT   19   20   24    1    1                                       
CONECT   20   21   19   42   43                                       
CONECT   21    5   20   44   45                                       
CONECT   22   10    9                                                 
CONECT   23   12   11                                                 
CONECT   24   19   17                                                 
CONECT   25    2                                                      
CONECT   26    2                                                      
CONECT   27    2                                                      
CONECT   28    6                                                      
CONECT   29    8                                                      
CONECT   30    8                                                      
CONECT   31    8                                                      
CONECT   32   10                                                      
CONECT   33   10                                                      
CONECT   34   10                                                      
CONECT   35   12                                                      
CONECT   36   12                                                      
CONECT   37   12                                                      
CONECT   38   13                                                      
CONECT   39   14                                                      
CONECT   40   15                                                      
CONECT   41   16                                                      
CONECT   42   20                                                      
CONECT   43   20                                                      
CONECT   44   21                                                      
CONECT   45   21                                                      
MASTER        0    0    0    0    0    0    0    0   45    0   45    0
END
