COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.901   0.253   1.933  1.00  0.00           C  
HETATM    2  C   UNL     1       4.977  -0.669   0.743  1.00  0.00           C  
HETATM    3  C   UNL     1       6.077  -1.483   0.568  1.00  0.00           C  
HETATM    4  C   UNL     1       5.117  -2.365  -1.445  1.00  0.00           C  
HETATM    5  C   UNL     1       4.009  -1.559  -1.277  1.00  0.00           C  
HETATM    6  C   UNL     1       3.933  -0.705  -0.179  1.00  0.00           C  
HETATM    7  C   UNL     1       2.744   0.163   0.007  1.00  0.00           C  
HETATM    8  C   UNL     1       0.401   0.416   0.483  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.001   0.405   0.270  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.198   0.674  -0.012  1.00  0.00           C  
HETATM   11  C   UNL     1      -5.646   0.352   0.253  1.00  0.00           C  
HETATM   12  C   UNL     1      -5.890  -1.138   0.008  1.00  0.00           C  
HETATM   13  C   UNL     1      -3.815   1.621  -0.868  1.00  0.00           C  
HETATM   14  C   UNL     1       0.527   1.794   0.352  1.00  0.00           C  
HETATM   15  C   UNL     1       1.753   2.353   0.046  1.00  0.00           C  
HETATM   16  C   UNL     1       2.860   1.546  -0.127  1.00  0.00           C  
HETATM   17  C   UNL     1       4.195   2.160  -0.462  1.00  0.00           C  
HETATM   18  C   UNL     1       6.148  -2.330  -0.524  1.00  0.00           C  
HETATM   19  C   UNL     1       1.508  -0.401   0.311  1.00  0.00           C  
HETATM   20  N   UNL     1      -0.841  -0.146   0.794  1.00  0.00           N  
HETATM   21  N   UNL     1      -3.205   0.039   0.585  1.00  0.00           N  
HETATM   22  C   UNL     1      -7.361  -1.465   0.276  1.00  0.00           C  
HETATM   23  O   UNL     1      -7.589  -2.857   0.047  1.00  0.00           O  
HETATM   24  S   UNL     1      -2.054   1.671  -0.878  1.00  0.00           S  
HETATM   25  H   UNL     1       5.429   1.180   1.708  1.00  0.00           H  
HETATM   26  H   UNL     1       3.857   0.474   2.156  1.00  0.00           H  
HETATM   27  H   UNL     1       5.363  -0.228   2.795  1.00  0.00           H  
HETATM   28  H   UNL     1       6.885  -1.459   1.285  1.00  0.00           H  
HETATM   29  H   UNL     1       5.177  -3.028  -2.296  1.00  0.00           H  
HETATM   30  H   UNL     1       3.205  -1.588  -1.998  1.00  0.00           H  
HETATM   31  H   UNL     1      -5.889   0.595   1.287  1.00  0.00           H  
HETATM   32  H   UNL     1      -6.276   0.938  -0.416  1.00  0.00           H  
HETATM   33  H   UNL     1      -5.647  -1.381  -1.027  1.00  0.00           H  
HETATM   34  H   UNL     1      -5.260  -1.725   0.676  1.00  0.00           H  
HETATM   35  H   UNL     1      -4.470   2.249  -1.454  1.00  0.00           H  
HETATM   36  H   UNL     1      -0.336   2.430   0.487  1.00  0.00           H  
HETATM   37  H   UNL     1       1.847   3.424  -0.055  1.00  0.00           H  
HETATM   38  H   UNL     1       4.268   2.307  -1.539  1.00  0.00           H  
HETATM   39  H   UNL     1       4.290   3.121   0.043  1.00  0.00           H  
HETATM   40  H   UNL     1       4.994   1.496  -0.131  1.00  0.00           H  
HETATM   41  H   UNL     1       7.011  -2.965  -0.657  1.00  0.00           H  
HETATM   42  H   UNL     1       1.412  -1.472   0.411  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.891  -0.921   1.375  1.00  0.00           H  
HETATM   44  H   UNL     1      -7.604  -1.222   1.310  1.00  0.00           H  
HETATM   45  H   UNL     1      -7.991  -0.879  -0.393  1.00  0.00           H  
HETATM   46  H   UNL     1      -8.502  -3.136   0.198  1.00  0.00           H  
CONECT    1    2   25   26   27                                       
CONECT    2    1    3    3    6                                       
CONECT    3    2    2   18   28                                       
CONECT    4    5   18   18   29                                       
CONECT    5    4    6    6   30                                       
CONECT    6    2    5    5    7                                       
CONECT    7    6   16   16   19                                       
CONECT    8   14   19   19   20                                       
CONECT    9   20   21   21   24                                       
CONECT   10   11   13   13   21                                       
CONECT   11   10   12   31   32                                       
CONECT   12   11   22   33   34                                       
CONECT   13   10   10   24   35                                       
CONECT   14    8   15   15   36                                       
CONECT   15   14   14   16   37                                       
CONECT   16    7    7   15   17                                       
CONECT   17   16   38   39   40                                       
CONECT   18    3    4    4   41                                       
CONECT   19    7    8    8   42                                       
CONECT   20    8    9   43                                            
CONECT   21    9    9   10                                            
CONECT   22   12   23   44   45                                       
CONECT   23   22   46                                                 
CONECT   24    9   13                                                 
CONECT   25    1                                                      
CONECT   26    1                                                      
CONECT   27    1                                                      
CONECT   28    3                                                      
CONECT   29    4                                                      
CONECT   30    5                                                      
CONECT   31   11                                                      
CONECT   32   11                                                      
CONECT   33   12                                                      
CONECT   34   12                                                      
CONECT   35   13                                                      
CONECT   36   14                                                      
CONECT   37   15                                                      
CONECT   38   17                                                      
CONECT   39   17                                                      
CONECT   40   17                                                      
CONECT   41   18                                                      
CONECT   42   19                                                      
CONECT   43   20                                                      
CONECT   44   22                                                      
CONECT   45   22                                                      
CONECT   46   23                                                      
MASTER        0    0    0    0    0    0    0    0   46    0   46    0
END
