COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       3.115  -1.911  -0.055  1.00  0.00           O  
HETATM    2  C   UNL     1       2.834  -0.732  -0.033  1.00  0.00           C  
HETATM    3  C   UNL     1       3.903   0.279  -0.024  1.00  0.00           C  
HETATM    4  C   UNL     1       5.241  -0.113   0.079  1.00  0.00           C  
HETATM    5  C   UNL     1       5.594  -1.575   0.182  1.00  0.00           C  
HETATM    6  C   UNL     1       6.237   0.840   0.086  1.00  0.00           C  
HETATM    7  C   UNL     1       5.916   2.183  -0.008  1.00  0.00           C  
HETATM    8  C   UNL     1       4.593   2.580  -0.111  1.00  0.00           C  
HETATM    9  C   UNL     1       3.586   1.638  -0.125  1.00  0.00           C  
HETATM   10  C   UNL     1       1.390  -0.302  -0.020  1.00  0.00           C  
HETATM   11  S   UNL     1       0.325  -1.765  -0.042  1.00  0.00           S  
HETATM   12  C   UNL     1      -1.258  -0.991  -0.022  1.00  0.00           C  
HETATM   13  N   UNL     1      -2.452  -1.646  -0.030  1.00  0.00           N  
HETATM   14  C   UNL     1      -3.444  -0.675  -0.008  1.00  0.00           C  
HETATM   15  C   UNL     1      -4.844  -0.701  -0.002  1.00  0.00           C  
HETATM   16  O   UNL     1      -5.449  -1.761  -0.019  1.00  0.00           O  
HETATM   17  N   UNL     1      -5.511   0.475   0.022  1.00  0.00           N  
HETATM   18  C   UNL     1      -4.825   1.653   0.041  1.00  0.00           C  
HETATM   19  N   UNL     1      -5.528   2.833   0.066  1.00  0.00           N  
HETATM   20  N   UNL     1      -3.513   1.693   0.038  1.00  0.00           N  
HETATM   21  C   UNL     1      -2.785   0.560   0.013  1.00  0.00           C  
HETATM   22  N   UNL     1      -1.467   0.307   0.008  1.00  0.00           N  
HETATM   23  H   UNL     1       5.626  -2.012  -0.816  1.00  0.00           H  
HETATM   24  H   UNL     1       6.570  -1.681   0.656  1.00  0.00           H  
HETATM   25  H   UNL     1       4.842  -2.089   0.780  1.00  0.00           H  
HETATM   26  H   UNL     1       7.271   0.539   0.166  1.00  0.00           H  
HETATM   27  H   UNL     1       6.700   2.925  -0.001  1.00  0.00           H  
HETATM   28  H   UNL     1       4.350   3.629  -0.189  1.00  0.00           H  
HETATM   29  H   UNL     1       2.555   1.949  -0.206  1.00  0.00           H  
HETATM   30  H   UNL     1       1.192   0.278   0.882  1.00  0.00           H  
HETATM   31  H   UNL     1       1.185   0.310  -0.898  1.00  0.00           H  
HETATM   32  H   UNL     1      -2.584  -2.607  -0.047  1.00  0.00           H  
HETATM   33  H   UNL     1      -6.481   0.480   0.026  1.00  0.00           H  
HETATM   34  H   UNL     1      -6.498   2.819   0.070  1.00  0.00           H  
HETATM   35  H   UNL     1      -5.054   3.679   0.080  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2   10    3    1    1                                       
CONECT    3    9    2    4    4                                       
CONECT    4    3    3    6    5                                       
CONECT    5    4   23   24   25                                       
CONECT    6    7    7    4   26                                       
CONECT    7    8    6    6   27                                       
CONECT    8    9    9    7   28                                       
CONECT    9    8    8    3   29                                       
CONECT   10   11    2   30   31                                       
CONECT   11   12   10                                                 
CONECT   12   22   22   13   11                                       
CONECT   13   14   12   32                                            
CONECT   14   21   21   15   13                                       
CONECT   15   17   14   16   16                                       
CONECT   16   15   15                                                 
CONECT   17   18   15   33                                            
CONECT   18   19   20   20   17                                       
CONECT   19   18   34   35                                            
CONECT   20   18   18   21                                            
CONECT   21   20   22   14   14                                       
CONECT   22   21   12   12                                            
CONECT   23    5                                                      
CONECT   24    5                                                      
CONECT   25    5                                                      
CONECT   26    6                                                      
CONECT   27    7                                                      
CONECT   28    8                                                      
CONECT   29    9                                                      
CONECT   30   10                                                      
CONECT   31   10                                                      
CONECT   32   13                                                      
CONECT   33   17                                                      
CONECT   34   19                                                      
CONECT   35   19                                                      
MASTER        0    0    0    0    0    0    0    0   35    0   35    0
END
