COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -1.674   2.021   0.162  1.00  0.00           N  
HETATM    2  N   UNL     1       0.830   0.606   3.152  1.00  0.00           N  
HETATM    3  C   UNL     1       1.451   0.104  -0.190  1.00  0.00           C  
HETATM    4  C   UNL     1       1.579   0.583  -1.636  1.00  0.00           C  
HETATM    5  C   UNL     1       2.237   1.964  -1.659  1.00  0.00           C  
HETATM    6  C   UNL     1       3.626   1.877  -1.024  1.00  0.00           C  
HETATM    7  C   UNL     1       3.497   1.398   0.424  1.00  0.00           C  
HETATM    8  C   UNL     1       0.584   1.086   0.601  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.867   3.097  -0.231  1.00  0.00           C  
HETATM   10  C   UNL     1       0.723   0.815   2.041  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.858   0.923   0.197  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.968   1.888  -0.193  1.00  0.00           C  
HETATM   13  O   UNL     1      -3.408   0.796  -0.481  1.00  0.00           O  
HETATM   14  N   UNL     1      -1.342  -0.242  -0.119  1.00  0.00           N  
HETATM   15  C   UNL     1      -0.576  -1.350  -0.146  1.00  0.00           C  
HETATM   16  S   UNL     1      -1.342  -2.937  -0.157  1.00  0.00           S  
HETATM   17  C   UNL     1      -3.084  -2.446  -0.124  1.00  0.00           C  
HETATM   18  C   UNL     1       0.799  -1.257  -0.166  1.00  0.00           C  
HETATM   19  C   UNL     1       1.603  -2.442  -0.165  1.00  0.00           C  
HETATM   20  N   UNL     1       2.240  -3.382  -0.164  1.00  0.00           N  
HETATM   21  C   UNL     1       2.838   0.017   0.447  1.00  0.00           C  
HETATM   22  H   UNL     1      -1.323   2.894   0.397  1.00  0.00           H  
HETATM   23  H   UNL     1       2.192  -0.121  -2.200  1.00  0.00           H  
HETATM   24  H   UNL     1       0.589   0.645  -2.088  1.00  0.00           H  
HETATM   25  H   UNL     1       2.330   2.306  -2.690  1.00  0.00           H  
HETATM   26  H   UNL     1       1.624   2.668  -1.097  1.00  0.00           H  
HETATM   27  H   UNL     1       4.240   1.173  -1.586  1.00  0.00           H  
HETATM   28  H   UNL     1       4.096   2.861  -1.040  1.00  0.00           H  
HETATM   29  H   UNL     1       4.487   1.336   0.876  1.00  0.00           H  
HETATM   30  H   UNL     1       2.884   2.103   0.986  1.00  0.00           H  
HETATM   31  H   UNL     1       0.906   2.106   0.391  1.00  0.00           H  
HETATM   32  H   UNL     1      -3.299   3.981   0.057  1.00  0.00           H  
HETATM   33  H   UNL     1      -4.257   3.228  -1.240  1.00  0.00           H  
HETATM   34  H   UNL     1      -4.696   2.955   0.463  1.00  0.00           H  
HETATM   35  H   UNL     1      -3.713  -3.336  -0.127  1.00  0.00           H  
HETATM   36  H   UNL     1      -3.280  -1.865   0.777  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.307  -1.840  -1.002  1.00  0.00           H  
HETATM   38  H   UNL     1       2.744  -0.323   1.478  1.00  0.00           H  
HETATM   39  H   UNL     1       3.452  -0.688  -0.114  1.00  0.00           H  
CONECT    1   12   11   22                                            
CONECT    2   10   10   10                                            
CONECT    3    8   21    4   18                                       
CONECT    4    3    5   23   24                                       
CONECT    5    6    4   25   26                                       
CONECT    6    7    5   27   28                                       
CONECT    7   21    6   29   30                                       
CONECT    8   10   11    3   31                                       
CONECT    9   12   32   33   34                                       
CONECT   10    2    2    2    8                                       
CONECT   11    1    8   14   14                                       
CONECT   12    9   13   13    1                                       
CONECT   13   12   12                                                 
CONECT   14   11   11   15                                            
CONECT   15   14   18   18   16                                       
CONECT   16   15   17                                                 
CONECT   17   16   35   36   37                                       
CONECT   18    3   15   15   19                                       
CONECT   19   18   20   20   20                                       
CONECT   20   19   19   19                                            
CONECT   21    7    3   38   39                                       
CONECT   22    1                                                      
CONECT   23    4                                                      
CONECT   24    4                                                      
CONECT   25    5                                                      
CONECT   26    5                                                      
CONECT   27    6                                                      
CONECT   28    6                                                      
CONECT   29    7                                                      
CONECT   30    7                                                      
CONECT   31    8                                                      
CONECT   32    9                                                      
CONECT   33    9                                                      
CONECT   34    9                                                      
CONECT   35   17                                                      
CONECT   36   17                                                      
CONECT   37   17                                                      
CONECT   38   21                                                      
CONECT   39   21                                                      
MASTER        0    0    0    0    0    0    0    0   39    0   39    0
END
