COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -3.409   2.804  -0.161  1.00  0.00           C  
HETATM    2  C   UNL     1      -2.411   3.150   0.733  1.00  0.00           C  
HETATM    3  C   UNL     1      -1.240   2.421   0.779  1.00  0.00           C  
HETATM    4  C   UNL     1      -3.243   1.723  -1.008  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.077   0.987  -0.971  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.978  -1.688   0.120  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.362  -3.373  -0.127  1.00  0.00           C  
HETATM    8  C   UNL     1      -2.163  -1.403   0.737  1.00  0.00           C  
HETATM    9  S   UNL     1       1.874  -1.393   0.083  1.00  0.00           S  
HETATM   10  C   UNL     1       0.210  -0.826   0.056  1.00  0.00           C  
HETATM   11  C   UNL     1       0.191   0.548  -0.033  1.00  0.00           C  
HETATM   12  C   UNL     1       1.443   1.130  -0.079  1.00  0.00           C  
HETATM   13  C   UNL     1       2.481   0.253  -0.028  1.00  0.00           C  
HETATM   14  C   UNL     1       3.902   0.627  -0.061  1.00  0.00           C  
HETATM   15  N   UNL     1       4.874  -0.352  -0.003  1.00  0.00           N  
HETATM   16  N   UNL     1       4.245   1.886  -0.145  1.00  0.00           N  
HETATM   17  C   UNL     1      -1.064   1.334  -0.077  1.00  0.00           C  
HETATM   18  N   UNL     1      -1.117  -2.946  -0.428  1.00  0.00           N  
HETATM   19  N   UNL     1      -2.977  -2.448   0.561  1.00  0.00           N  
HETATM   20  H   UNL     1      -4.324   3.377  -0.193  1.00  0.00           H  
HETATM   21  H   UNL     1      -2.548   3.992   1.395  1.00  0.00           H  
HETATM   22  H   UNL     1      -0.461   2.692   1.476  1.00  0.00           H  
HETATM   23  H   UNL     1      -4.028   1.456  -1.700  1.00  0.00           H  
HETATM   24  H   UNL     1      -1.948   0.144  -1.633  1.00  0.00           H  
HETATM   25  H   UNL     1      -2.784  -4.326  -0.412  1.00  0.00           H  
HETATM   26  H   UNL     1      -2.399  -0.496   1.273  1.00  0.00           H  
HETATM   27  H   UNL     1       1.586   2.198  -0.149  1.00  0.00           H  
HETATM   28  H   UNL     1       4.620  -1.285   0.059  1.00  0.00           H  
HETATM   29  H   UNL     1       5.812  -0.105  -0.024  1.00  0.00           H  
HETATM   30  H   UNL     1       5.183   2.132  -0.166  1.00  0.00           H  
HETATM   31  H   UNL     1      -0.446  -3.433  -0.930  1.00  0.00           H  
CONECT    1    2    2    4   20                                       
CONECT    2    3    1    1   21                                       
CONECT    3   17   17    2   22                                       
CONECT    4    5    5    1   23                                       
CONECT    5   17    4    4   24                                       
CONECT    6   18    8    8   10                                       
CONECT    7   18   19   19   25                                       
CONECT    8   19    6    6   26                                       
CONECT    9   10   13                                                 
CONECT   10    9    6   11   11                                       
CONECT   11   10   10   12   17                                       
CONECT   12   13   13   11   27                                       
CONECT   13    9   14   12   12                                       
CONECT   14   16   16   13   15                                       
CONECT   15   14   28   29                                            
CONECT   16   14   14   30                                            
CONECT   17   11    3    3    5                                       
CONECT   18    7    6   31                                            
CONECT   19    7    7    8                                            
CONECT   20    1                                                      
CONECT   21    2                                                      
CONECT   22    3                                                      
CONECT   23    4                                                      
CONECT   24    5                                                      
CONECT   25    7                                                      
CONECT   26    8                                                      
CONECT   27   12                                                      
CONECT   28   15                                                      
CONECT   29   15                                                      
CONECT   30   16                                                      
CONECT   31   18                                                      
MASTER        0    0    0    0    0    0    0    0   31    0   31    0
END
